6-[(Z)-[(2-ethyl-6-methyl-phenyl)carbamothioylhydrazinylidene]methyl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[(Z)-[(2-ethyl-6-methyl-phenyl)carbamothioylhydrazinylidene]methyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[(Z)-[(2-ethyl-6-methyl-phenyl)carbamothioylhydrazono]methyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[(Z)-[[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[(Z)-[(2-ethyl-6-methylphenyl)carbamothioylhydrazinylidene]methyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[(Z)-[(2-ethyl-6-methyl-phenyl)thiocarbamoylhydrazono]methyl]-2,3-dimethoxy-benzoic acid Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NN=CC2=C(C(=C(C=C2)OC)OC)C(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N/N=C\C2=C(C(=C(C=C2)OC)OC)C(=O)O)C

InChI

InChI=1S/C20H23N3O4S/c1-5-13-8-6-7-12(2)17(13)22-20(28)23-21-11-14-9-10-15(26-3)18(27-4)16(14)19(24)25/h6-11H,5H2,1-4H3,(H,24,25)(H2,22,23,28)/b21-11-