(phenylmethyl) 1-[methyl-[2-oxidanylidene-4-phenyl-3-(phenylmethoxycarbonylamino)butyl]carbamoyl]-4-phenylsulfanyl-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[methyl-[2-oxidanylidene-4-phenyl-3-(phenylmethoxycarbonylamino)butyl]carbamoyl]-4-phenylsulfanyl-pyrrolidine-2-carboxylate Openeye Name: benzyl 1-[[3-(benzyloxycarbonylamino)-2-oxo-4-phenyl-butyl]-methyl-carbamoyl]-4-phenylsulfanyl-pyrrolidine-2-carboxylate CAS Name: 1-[[methyl-[2-oxo-4-phenyl-3-(phenylmethoxycarbonylamino)butyl]amino]-oxomethyl]-4-(phenylthio)-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[methyl-[2-oxo-4-phenyl-3-(phenylmethoxycarbonylamino)butyl]carbamoyl]-4-phenylsulfanylpyrrolidine-2-carboxylate Traditional Name: 1-[[3-(benzyloxycarbonylamino)-2-keto-4-phenyl-butyl]-methyl-carbamoyl]-4-(phenylthio)pyrrolidine-2-carboxylic acid benzyl ester Formula: C38H39N3O6S MolecularWeight: 665.79776

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(=O)N3CC(CC3C(=O)OCC4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(=O)N3CC(CC3C(=O)OCC4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C38H39N3O6S/c1-40(25-35(42)33(22-28-14-6-2-7-15-28)39-37(44)47-27-30-18-10-4-11-19-30)38(45)41-24-32(48-31-20-12-5-13-21-31)23-34(41)36(43)46-26-29-16-8-3-9-17-29/h2-21,32-34H,22-27H2,1H3,(H,39,44)