(E)-4-[2-[(2-methylphenyl)carbamothioyl]hydrazinyl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2-[(2-methylphenyl)carbamothioyl]hydrazinyl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-(o-tolylcarbamothioyl)hydrazino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[(2-methylanilino)-sulfanylidenemethyl]hydrazo]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-[(2-methylphenyl)carbamothioyl]hydrazinyl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[N'-(o-tolylthiocarbamoyl)hydrazino]but-2-enoic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C=CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H13N3O3S/c1-8-4-2-3-5-9(8)13-12(19)15-14-10(16)6-7-11(17)18/h2-7H,1H3,(H,14,16)(H,17,18)(H2,13,15,19)/b7-6+