2-[(E)-C-ethanoyl-N-[(4-methylphenyl)amino]carbonimidoyl]sulfanylbenzoic acid

Systemtic Name: 2-[(E)-C-ethanoyl-N-[(4-methylphenyl)amino]carbonimidoyl]sulfanylbenzoic acid Openeye Name: 2-[(E)-C-acetyl-N-(4-methylanilino)carbonimidoyl]sulfanylbenzoic acid CAS Name: 2-[[(1E)-1-[(4-methylphenyl)hydrazinylidene]-2-oxopropyl]thio]benzoic acid IUPAC Name: 2-[(E)-C-acetyl-N-(4-methylanilino)carbonimidoyl]sulfanylbenzoic acid Traditional Name: 2-[[(E)-C-acetyl-N-(p-toluidino)carbonimidoyl]thio]benzoic acid Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C(C(=O)C)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C(\C(=O)C)/SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H16N2O3S/c1-11-7-9-13(10-8-11)18-19-16(12(2)20)23-15-6-4-3-5-14(15)17(21)22/h3-10,18H,1-2H3,(H,21,22)/b19-16+