2-[(3-acetamidophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(3-acetamidophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(3-acetamidobenzoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(3-acetamidophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3-acetamidobenzoyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(3-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=CC(=C1)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

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

InChI

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