4-[(Z)-[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoate

Systemtic Name: 4-[(Z)-[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoate Openeye Name: 4-[(Z)-[(2,6-dimethylphenyl)carbamothioylhydrazono]methyl]benzoate CAS Name: 4-[(Z)-[[(2,6-dimethylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoate IUPAC Name: 4-[(Z)-[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoate Traditional Name: 4-[(Z)-[(2,6-dimethylphenyl)thiocarbamoylhydrazono]methyl]benzoate Formula: C17H16N3O2S- MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NN=CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N/N=C\C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C17H17N3O2S/c1-11-4-3-5-12(2)15(11)19-17(23)20-18-10-13-6-8-14(9-7-13)16(21)22/h3-10H,1-2H3,(H,21,22)(H2,19,20,23)/p-1/b18-10-