methyl 4-methylsulfanyl-2-[3-[5-oxidanylidene-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[3-[5-oxidanylidene-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoylamino]butanoate Openeye Name: methyl 4-methylsulfanyl-2-[3-[5-oxo-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoylamino]butanoate CAS Name: 4-(methylthio)-2-[[1-oxo-3-[5-oxo-2-[(4-phenylphenyl)methyl]-2-pyrrolidinyl]propyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-[3-[5-oxo-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoylamino]butanoate Traditional Name: 2-[3-[5-keto-2-(4-phenylbenzyl)pyrrolidin-2-yl]propanoylamino]-4-(methylthio)butyric acid methyl ester Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)CCC1(CCC(=O)N1)CC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)CCC1(CCC(=O)N1)CC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O4S/c1-32-25(31)22(14-17-33-2)27-23(29)12-15-26(16-13-24(30)28-26)18-19-8-10-21(11-9-19)20-6-4-3-5-7-20/h3-11,22H,12-18H2,1-2H3,(H,27,29)(H,28,30)