4-azanyl-2-[(2-methylsulfanylphenyl)carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[(2-methylsulfanylphenyl)carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(2-methylsulfanylbenzoyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[[2-(methylthio)phenyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(2-methylsulfanylbenzoyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-4-keto-2-[[2-(methylthio)benzoyl]amino]butyric acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C12H14N2O4S/c1-19-9-5-3-2-4-7(9)11(16)14-8(12(17)18)6-10(13)15/h2-5,8H,6H2,1H3,(H2,13,15)(H,14,16)(H,17,18)