2-[(4-acetamidophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4-acetamidophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(4-acetamidobenzoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(4-acetamidophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4-acetamidobenzoyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-acetamidobenzoyl)amino]-4-(methylthio)butyric acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-9(17)15-11-5-3-10(4-6-11)13(18)16-12(14(19)20)7-8-21-2/h3-6,12H,7-8H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)