methyl 4-methylsulfanyl-2-[2-[4-(phenylcarbonyl)phenyl]ethanoylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[2-[4-(phenylcarbonyl)phenyl]ethanoylamino]butanoate Openeye Name: methyl 2-[[2-(4-benzoylphenyl)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[2-(4-benzoylphenyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-benzoylphenyl)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(4-benzoylphenyl)acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO4S/c1-26-21(25)18(12-13-27-2)22-19(23)14-15-8-10-17(11-9-15)20(24)16-6-4-3-5-7-16/h3-11,18H,12-14H2,1-2H3,(H,22,23)