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Azolidine

Organische heterozyklische Verbindungen, die aus einem fünfgliedrigen Ring bestehen, der aus vier Kohlenstoffatomen und einem Stickstoffatom mit folgender molekularer Formel besteht: C4H9N.

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1

3-Phenylhydantoin, 95 %, Thermo Scientific Chemicals

CAS: 2221-13-8 Summenformel: C9H8N2O2 Molekulargewicht (g/mol): 176.18 MDL-Nummer: MFCD00209486 InChI-Schlüssel: RUEGAVIENIPHGK-UHFFFAOYSA-N PubChem CID: 227930 IUPAC-Name: 3-Phenylimidazolidin-2,4-Dion SMILES: O=C1CNC(=O)N1C1=CC=CC=C1

InChI-Schlüssel RUEGAVIENIPHGK-UHFFFAOYSA-N
IUPAC-Name 3-Phenylimidazolidin-2,4-Dion
PubChem CID 227930
CAS 2221-13-8
MDL-Nummer MFCD00209486
Molekulargewicht (g/mol) 176.18
SMILES O=C1CNC(=O)N1C1=CC=CC=C1
Summenformel C9H8N2O2
3

Rhodanin-3-essigsäure, 98 %, Thermo Scientific Chemicals

CAS: 5718-83-2 Summenformel: C5H5NO3S2 Molekulargewicht (g/mol): 191.22 MDL-Nummer: MFCD00005491 InChI-Schlüssel: JGRMXPSUZIYDRR-UHFFFAOYSA-N Synonym: rhodanine-3-acetic acid,rhodanine-n-acetic acid,n-carboxymethylrhodanine,3-rhodanineacetic acid,3-thiazolidineacetic acid, 4-oxo-2-thioxo,3-carboxymethyl rhodanine,n-carboxymethyl rhodanine,2-4-oxo-2-thioxothiazolidin-3-yl acetic acid,4-oxo-2-thioxo-3-thiazolidineacetic acid,4-oxo-2-thioxo-3-thiazolidinylacetic acid PubChem CID: 79793 IUPAC-Name: 2-(4-Oxo-2-Sulfanyliden-1,3-Thiazolidin-3-yl)Ethansäure SMILES: OC(=O)CN1C(=O)CSC1=S

InChI-Schlüssel JGRMXPSUZIYDRR-UHFFFAOYSA-N
IUPAC-Name 2-(4-Oxo-2-Sulfanyliden-1,3-Thiazolidin-3-yl)Ethansäure
PubChem CID 79793
CAS 5718-83-2
MDL-Nummer MFCD00005491
Molekulargewicht (g/mol) 191.22
SMILES OC(=O)CN1C(=O)CSC1=S
Synonym rhodanine-3-acetic acid,rhodanine-n-acetic acid,n-carboxymethylrhodanine,3-rhodanineacetic acid,3-thiazolidineacetic acid, 4-oxo-2-thioxo,3-carboxymethyl rhodanine,n-carboxymethyl rhodanine,2-4-oxo-2-thioxothiazolidin-3-yl acetic acid,4-oxo-2-thioxo-3-thiazolidineacetic acid,4-oxo-2-thioxo-3-thiazolidinylacetic acid
Summenformel C5H5NO3S2
4

tert-Butyl (S)-(-)-4-formyl-2,2-dimethyl-3-oxazolidincarboxylat, 95 %, Thermo Scientific Chemicals

CAS: 102308-32-7 Summenformel: C11H19NO4 Molekulargewicht (g/mol): 229.28 MDL-Nummer: MFCD00209557 InChI-Schlüssel: PNJXYVJNOCLJLJ-MRVPVSSYSA-N Synonym: s---3-boc-2,2-dimethyloxazolidine-4-carboxaldehyde,tert-butyl s---4-formyl-2,2-dimethyl-3-oxazolidinecarboxylate,tert-butyl 4s-4-formyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate,unii-41aj913hqi,s-tert-butyl 4-formyl-2,2-dimethyloxazolidine-3-carboxylate,1,1-dimethylethyl-s-4-formyl-2,2-dimethyl-3-oxazolidine carboxylate,s---3-tert-butoxycarbonyl-4-formyl-2,2-dimethyl-1,3-oxazolidine,s-4-formyl-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester,3-oxazolidinecarboxylic acid, 4-formyl-2,2-dimethyl-, 1,1-dimethylethyl ester, 4s,s---3-boc-4-formyl-2,2-dimethyl-1,3-oxazolidine PubChem CID: 179824 IUPAC-Name: Tert-Butyl (4S)-4-Formyl-2,2-Dimethyl-1,3-Oxazolidin-3-Carboxylat SMILES: CC1(N(C(CO1)C=O)C(=O)OC(C)(C)C)C

InChI-Schlüssel PNJXYVJNOCLJLJ-MRVPVSSYSA-N
IUPAC-Name Tert-Butyl (4S)-4-Formyl-2,2-Dimethyl-1,3-Oxazolidin-3-Carboxylat
PubChem CID 179824
CAS 102308-32-7
MDL-Nummer MFCD00209557
Molekulargewicht (g/mol) 229.28
SMILES CC1(N(C(CO1)C=O)C(=O)OC(C)(C)C)C
Synonym s---3-boc-2,2-dimethyloxazolidine-4-carboxaldehyde,tert-butyl s---4-formyl-2,2-dimethyl-3-oxazolidinecarboxylate,tert-butyl 4s-4-formyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate,unii-41aj913hqi,s-tert-butyl 4-formyl-2,2-dimethyloxazolidine-3-carboxylate,1,1-dimethylethyl-s-4-formyl-2,2-dimethyl-3-oxazolidine carboxylate,s---3-tert-butoxycarbonyl-4-formyl-2,2-dimethyl-1,3-oxazolidine,s-4-formyl-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester,3-oxazolidinecarboxylic acid, 4-formyl-2,2-dimethyl-, 1,1-dimethylethyl ester, 4s,s---3-boc-4-formyl-2,2-dimethyl-1,3-oxazolidine
Summenformel C11H19NO4
5

3-Ethyl-2-methyl-2-(3-methylbutyl)-oxazolidine, TRC

CAS: 143860-04-2 Summenformel: C11 H23 N O Molekulargewicht (g/mol): 185.31 Synonym: Oxazolidine, 3-ethyl-2-methyl-2-(3-methylbutyl)-,3-Ethyl-2-methyl-2-(3-methylbutyl)oxazolidine,3-Ethyl-2-methyl-2-(3-methylbutyl)-1,3-oxazolidine,MS-PLUS,Zoldine MS-PLUS IUPAC-Name: 3-ethyl-2-methyl-2-(3-methylbutyl)-1,3-oxazolidine SMILES: CCN1CCOC1(C)CCC(C)C

IUPAC-Name 3-ethyl-2-methyl-2-(3-methylbutyl)-1,3-oxazolidine
CAS 143860-04-2
Molekulargewicht (g/mol) 185.31
SMILES CCN1CCOC1(C)CCC(C)C
Synonym Oxazolidine, 3-ethyl-2-methyl-2-(3-methylbutyl)-,3-Ethyl-2-methyl-2-(3-methylbutyl)oxazolidine,3-Ethyl-2-methyl-2-(3-methylbutyl)-1,3-oxazolidine,MS-PLUS,Zoldine MS-PLUS
Summenformel C11 H23 N O
6

(+/-)-N-3-Benzylnirvanol, TRC

CAS: 93879-40-4 Summenformel: C18 H18 N2 O2 Molekulargewicht (g/mol): 294.35 IUPAC-Name: 3-benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione SMILES: CCC1(NC(=O)N(Cc2ccccc2)C1=O)c3ccccc3

IUPAC-Name 3-benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CAS 93879-40-4
Molekulargewicht (g/mol) 294.35
SMILES CCC1(NC(=O)N(Cc2ccccc2)C1=O)c3ccccc3
Summenformel C18 H18 N2 O2
7

3-Phenyl-2-oxazolidinone, TRC

CAS: 703-56-0 Summenformel: C9H9NO2 Molekulargewicht (g/mol): 163.17 IUPAC-Name: 3-phenyl-1,3-oxazolidin-2-one SMILES: O=C1OCCN1c2ccccc2

IUPAC-Name 3-phenyl-1,3-oxazolidin-2-one
CAS 703-56-0
Molekulargewicht (g/mol) 163.17
SMILES O=C1OCCN1c2ccccc2
Summenformel C9H9NO2
8

3-Amino-2-oxazolidinone, TRC

CAS: 80-65-9 Summenformel: C3 H6 N2 O2 Molekulargewicht (g/mol): 102.09 Synonym: 3-Amino-2-oxazolidinone,3-Amino-1,3-oxazolidin-2-one,3-Amino-2-oxazolidone,NSC 111187,NSC 196570,NSC 38250 IUPAC-Name: 3-amino-1,3-oxazolidin-2-one SMILES: NN1CCOC1=O

IUPAC-Name 3-amino-1,3-oxazolidin-2-one
CAS 80-65-9
Molekulargewicht (g/mol) 102.09
SMILES NN1CCOC1=O
Synonym 3-Amino-2-oxazolidinone,3-Amino-1,3-oxazolidin-2-one,3-Amino-2-oxazolidone,NSC 111187,NSC 196570,NSC 38250
Summenformel C3 H6 N2 O2
9

(S)-(+)-N-3-Benzylnirvanol, TRC

CAS: 790676-40-3 Summenformel: C18 H18 N2 O2 Molekulargewicht (g/mol): 294.35 IUPAC-Name: (5S)-3-benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione SMILES: CC[C@]1(NC(=O)N(Cc2ccccc2)C1=O)c3ccccc3

IUPAC-Name (5S)-3-benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CAS 790676-40-3
Molekulargewicht (g/mol) 294.35
SMILES CC[C@]1(NC(=O)N(Cc2ccccc2)C1=O)c3ccccc3
Summenformel C18 H18 N2 O2
10

3-(Dichloroacetyl)-2,2,5-trimethyloxazolidine, TRC

CAS: 52836-31-4 Summenformel: C8 H13 Cl2 N O2 Molekulargewicht (g/mol): 226.1 Synonym: Oxazolidine, 3-(dichloroacetyl)-2,2,5-trimethyl- (9CI),2,2-Dichloro-1-(2,2,5-trimethyl-3-oxazolidinyl)ethanone,2,2,5-Trimethyl-3-(dichloroacetyl)-1,3-oxazolidine,2,2,5-Trimethyl-3-(dichloroacetyl)oxazolidine,R 29148 IUPAC-Name: 2,2-dichloro-1-(2,2,5-trimethyl-1,3-oxazolidin-3-yl)ethanone SMILES: CC1CN(C(=O)C(Cl)Cl)C(C)(C)O1

IUPAC-Name 2,2-dichloro-1-(2,2,5-trimethyl-1,3-oxazolidin-3-yl)ethanone
CAS 52836-31-4
Molekulargewicht (g/mol) 226.1
SMILES CC1CN(C(=O)C(Cl)Cl)C(C)(C)O1
Synonym Oxazolidine, 3-(dichloroacetyl)-2,2,5-trimethyl- (9CI),2,2-Dichloro-1-(2,2,5-trimethyl-3-oxazolidinyl)ethanone,2,2,5-Trimethyl-3-(dichloroacetyl)-1,3-oxazolidine,2,2,5-Trimethyl-3-(dichloroacetyl)oxazolidine,R 29148
Summenformel C8 H13 Cl2 N O2
11

4-[3-[4-Cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-fluorobenzamide, TRC

CAS: 1242137-16-1 Summenformel: C20 H14 F4 N4 O2 S Molekulargewicht (g/mol): 450.41 Synonym: 4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl)-2-fluorobenzamide IUPAC-Name: 4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-2-fluorobenzamide SMILES: CC1(C)N(C(=S)N(C1=O)c2ccc(C#N)c(c2)C(F)(F)F)c3ccc(C(=O)N)c(F)c3

IUPAC-Name 4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-2-fluorobenzamide
CAS 1242137-16-1
Molekulargewicht (g/mol) 450.41
SMILES CC1(C)N(C(=S)N(C1=O)c2ccc(C#N)c(c2)C(F)(F)F)c3ccc(C(=O)N)c(F)c3
Synonym 4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl)-2-fluorobenzamide
Summenformel C20 H14 F4 N4 O2 S
12

2-Methyl-4-isothiazolin-3-one Hydrochloride, TRC

CAS: 26172-54-3 Summenformel: C4 H5 N O S . Cl H Molekulargewicht (g/mol): 151.61 Synonym: 2-Methyl-4-isothiazolin-3-one Hydrochloride,2-Methylisothiazol-3-one hydrochloride,3(2H)-Isothiazolone, 2-methyl-, hydrochloride (1:1),3(2H)-Isothiazolone, 2-methyl-, hydrochloride (9CI),4-Isothiazolin-3-one, 2-methyl-, hydrochloride (8CI),2-Methyl-3-isothiazolone hydrochloride,2-Methyl-4-isothiazolin-3-one hydrochloride IUPAC-Name: 2-methyl-1,2-thiazol-3-one;hydrochloride SMILES: Cl.CN1SC=CC1=O

IUPAC-Name 2-methyl-1,2-thiazol-3-one;hydrochloride
CAS 26172-54-3
Molekulargewicht (g/mol) 151.61
SMILES Cl.CN1SC=CC1=O
Synonym 2-Methyl-4-isothiazolin-3-one Hydrochloride,2-Methylisothiazol-3-one hydrochloride,3(2H)-Isothiazolone, 2-methyl-, hydrochloride (1:1),3(2H)-Isothiazolone, 2-methyl-, hydrochloride (9CI),4-Isothiazolin-3-one, 2-methyl-, hydrochloride (8CI),2-Methyl-3-isothiazolone hydrochloride,2-Methyl-4-isothiazolin-3-one hydrochloride
Summenformel C4 H5 N O S . Cl H
13

(S)-4-(1-Isopropyl)-3-(1-oxobutyl)-2-oxazolidinone, TRC

CAS: 80697-93-4 Summenformel: C10 H17 N O3 Molekulargewicht (g/mol): 199.25 IUPAC-Name: (4S)-3-butanoyl-4-propan-2-yl-1,3-oxazolidin-2-one SMILES: CCCC(=O)N1[C@H](COC1=O)C(C)C

IUPAC-Name (4S)-3-butanoyl-4-propan-2-yl-1,3-oxazolidin-2-one
CAS 80697-93-4
Molekulargewicht (g/mol) 199.25
SMILES CCCC(=O)N1[C@H](COC1=O)C(C)C
Summenformel C10 H17 N O3
15

N-Phenylrhodanin, +97 %, Thermo Scientific™

CAS: 1457-46-1 Summenformel: C9H7NOS2 Molekulargewicht (g/mol): 209.29 MDL-Nummer: MFCD00100196 InChI-Schlüssel: DVRWEKGUWZINTQ-UHFFFAOYSA-N Synonym: 3-phenylrhodanine,n-phenylrhodanine,3-phenylrhodanin,rhodanine, 3-phenyl,4-thiazolidinone, 3-phenyl-2-thioxo,3-phenylrodanin,n-phenyl-rhodanine,3-phenyl-2-thioxo-1,3-thiazolidin-4-one,3-phenyl-2-thioxo-thiazolidin-4-one,3-phenyl-rhodanin german PubChem CID: 73822 IUPAC-Name: 3-Phenyl-2-Sulfanyliden-1,3-Thiazolidin-4-on SMILES: C1C(=O)N(C(=S)S1)C2=CC=CC=C2

InChI-Schlüssel DVRWEKGUWZINTQ-UHFFFAOYSA-N
IUPAC-Name 3-Phenyl-2-Sulfanyliden-1,3-Thiazolidin-4-on
PubChem CID 73822
CAS 1457-46-1
MDL-Nummer MFCD00100196
Molekulargewicht (g/mol) 209.29
SMILES C1C(=O)N(C(=S)S1)C2=CC=CC=C2
Synonym 3-phenylrhodanine,n-phenylrhodanine,3-phenylrhodanin,rhodanine, 3-phenyl,4-thiazolidinone, 3-phenyl-2-thioxo,3-phenylrodanin,n-phenyl-rhodanine,3-phenyl-2-thioxo-1,3-thiazolidin-4-one,3-phenyl-2-thioxo-thiazolidin-4-one,3-phenyl-rhodanin german
Summenformel C9H7NOS2