butyl N-(2-azanyl-3-phenyl-propanoyl)-N-[1-[[1-cyclohexyl-3-oxidanyl-4-(1,3-thiazol-2-ylsulfanyl)butan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: butyl N-(2-azanyl-3-phenyl-propanoyl)-N-[1-[[1-cyclohexyl-3-oxidanyl-4-(1,3-thiazol-2-ylsulfanyl)butan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: butyl N-(2-amino-3-phenyl-propanoyl)-N-[2-[[1-(cyclohexylmethyl)-2-hydroxy-3-thiazol-2-ylsulfanyl-propyl]amino]-1-(4H-imidazol-4-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-(2-amino-1-oxo-3-phenylpropyl)-N-[1-[[1-cyclohexyl-3-hydroxy-4-(2-thiazolylthio)butan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]carbamic acid butyl ester IUPAC Name: butyl N-(2-amino-3-phenylpropanoyl)-N-[1-[[1-cyclohexyl-3-hydroxy-4-(1,3-thiazol-2-ylsulfanyl)butan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[1-(cyclohexylmethyl)-2-hydroxy-3-(thiazol-2-ylthio)propyl]amino]-1-(4H-imidazol-4-ylmethyl)-2-keto-ethyl]-N-phenylalanyl-carbamic acid butyl ester Formula: C33H46N6O5S2 MolecularWeight: 670.88554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N(C(CC1C=NC=N1)C(=O)NC(CC2CCCCC2)C(CSC3=NC=CS3)O)C(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

CCCCOC(=O)N(C(CC1C=NC=N1)C(=O)NC(CC2CCCCC2)C(CSC3=NC=CS3)O)C(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C33H46N6O5S2/c1-2-3-15-44-33(43)39(31(42)26(34)17-23-10-6-4-7-11-23)28(19-25-20-35-22-37-25)30(41)38-27(18-24-12-8-5-9-13-24)29(40)21-46-32-36-14-16-45-32/h4,6-7,10-11,14,16,20,22,24-29,40H,2-3,5,8-9,12-13,15,17-19,21,34H2,1H3,(H,38,41)