methyl 2-[(4-aminophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-aminophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-aminobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-aminophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-aminobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-aminobenzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC=C(C=C1)N

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=CC=C(C=C1)N

InChI

InChI=1S/C13H18N2O3S/c1-18-13(17)11(7-8-19-2)15-12(16)9-3-5-10(14)6-4-9/h3-6,11H,7-8,14H2,1-2H3,(H,15,16)