4-[2-[(3-methylphenyl)carbamothioyl]hydrazinyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[(3-methylphenyl)carbamothioyl]hydrazinyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(m-tolylcarbamothioyl)hydrazino]-4-oxo-butanoic acid CAS Name: 4-[[(3-methylanilino)-sulfanylidenemethyl]hydrazo]-4-oxobutanoic acid IUPAC Name: 4-[2-[(3-methylphenyl)carbamothioyl]hydrazinyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[N'-(m-tolylthiocarbamoyl)hydrazino]butyric acid Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC(=O)CCC(=O)O

InChI

InChI=1S/C12H15N3O3S/c1-8-3-2-4-9(7-8)13-12(19)15-14-10(16)5-6-11(17)18/h2-4,7H,5-6H2,1H3,(H,14,16)(H,17,18)(H2,13,15,19)