CAS RN 171228-49-2
IUPAC Name:
4-{4-[4-(4-{[(3R,5R)-5-(2,4-difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-1-[(2S,3S)-2-hydroxypentan-3-yl]-4,5-dihydro-1H-1,2,4-triazol-5-one
Synonyme:
posaconazole
Molekulargewicht (g/mol):
700.79
Summenformel:
C37H42F2N8O4
InChi Key:
RAGOYPUPXAKGKH-XAKZXMRKSA-N
SMILES:
CC[C@@H]([C@H](C)O)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@@H]2CO[C@](CN3C=NC=N3)(C2)C2=CC=C(F)C=C2F)C=C1
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Posaconazole, TRC
CAS: 171228-49-2 Summenformel: C37 H42 F2 N8 O4 Molekulargewicht (g/mol): 700.78 Synonym: D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-[4-[4-[1-[(1S,2S)-1-ethyl-2-hydroxypropyl]-1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-,Noxafil,Posaconazole,Sch 56592 IUPAC-Name: 4-[4-[4-[4-[[(3R,5R)-5-(2,4-Difluorophenyl)-5-(1,2,4-Triazol-1-ylmethyl)Oxolan-3-yl]Methoxy]Phenyl]Piperazin-1-yl]Phenyl]-2-[(2S,3S)-2-Hydroxypentan-3-yl]-1,2,4-Triazol-3-one SMILES: CC[C@@H]([C@H](C)O)N1N=CN(C1=O)c2ccc(cc2)N3CCN(CC3)c4ccc(OC[C@@H]5CO[C@](Cn6cncn6)(C5)c7ccc(F)cc7F)cc4