methyl 2-[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-[1-(3-chlorophenyl)pentoxymethyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C32H38ClNO4S MolecularWeight: 568.16642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=CC=C1)Cl)OCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3C

Isomeric SMILES

CCCCC(C1=CC(=CC=C1)Cl)OCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3C

InChI

InChI=1S/C32H38ClNO4S/c1-5-6-14-30(24-11-9-12-25(33)20-24)38-21-23-15-16-27(28(19-23)26-13-8-7-10-22(26)2)31(35)34-29(17-18-39-4)32(36)37-3/h7-13,15-16,19-20,29-30H,5-6,14,17-18,21H2,1-4H3,(H,34,35)