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

Systemtic Name: methyl 4-[(E)-[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[(2,6-dimethylphenyl)carbamothioylhydrazono]methyl]benzoate CAS Name: 4-[(E)-[[(2,6-dimethylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[(2,6-dimethylphenyl)carbamothioylhydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[(2,6-dimethylphenyl)thiocarbamoylhydrazono]methyl]benzoic acid methyl ester Formula: C18H19N3O2S MolecularWeight: 341.42736

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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)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N/N=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H19N3O2S/c1-12-5-4-6-13(2)16(12)20-18(24)21-19-11-14-7-9-15(10-8-14)17(22)23-3/h4-11H,1-3H3,(H2,20,21,24)/b19-11+