N-[1-[[3-cyclohexyl-1-(1H-imidazol-2-yl)-1-oxidanyl-propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-4-cyclohexylsulfanyl-3-phenyl-butanamide

Systemtic Name: N-[1-[[3-cyclohexyl-1-(1H-imidazol-2-yl)-1-oxidanyl-propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-4-cyclohexylsulfanyl-3-phenyl-butanamide Openeye Name: N-[2-[[1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]-4-cyclohexylsulfanyl-3-phenyl-butanamide CAS Name: N-[1-[[3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-4-(cyclohexylthio)-3-phenylbutanamide IUPAC Name: N-[1-[[3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-4-cyclohexylsulfanyl-3-phenylbutanamide Traditional Name: N-[2-[[1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]-4-(cyclohexylthio)-3-phenyl-butyramide Formula: C34H48N6O3S MolecularWeight: 620.84832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(C2=NC=CN2)O)NC(=O)C(CC3=CN=CN3)NC(=O)CC(CSC4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CC(C(C2=NC=CN2)O)NC(=O)C(CC3=CN=CN3)NC(=O)CC(CSC4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C34H48N6O3S/c41-31(19-26(25-12-6-2-7-13-25)22-44-28-14-8-3-9-15-28)39-30(20-27-21-35-23-38-27)34(43)40-29(18-24-10-4-1-5-11-24)32(42)33-36-16-17-37-33/h2,6-7,12-13,16-17,21,23-24,26,28-30,32,42H,1,3-5,8-11,14-15,18-20,22H2,(H,35,38)(H,36,37)(H,39,41)(H,40,43)