4-[methyl-[4-(methylcarbamothioyl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[methyl-[4-(methylcarbamothioyl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[N-methyl-4-(methylcarbamothioyl)anilino]-4-oxo-butanoic acid CAS Name: 4-[N-methyl-4-[methylamino(sulfanylidene)methyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[N-methyl-4-(methylcarbamothioyl)anilino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[N-methyl-4-(methylthiocarbamoyl)anilino]butyric acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1=CC=C(C=C1)N(C)C(=O)CCC(=O)O

Isomeric SMILES

CNC(=S)C1=CC=C(C=C1)N(C)C(=O)CCC(=O)O

InChI

InChI=1S/C13H16N2O3S/c1-14-13(19)9-3-5-10(6-4-9)15(2)11(16)7-8-12(17)18/h3-6H,7-8H2,1-2H3,(H,14,19)(H,17,18)