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

Systemtic Name: 6-[(Z)-[(2-fluorophenyl)carbamothioylhydrazinylidene]methyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[(Z)-[(2-fluorophenyl)carbamothioylhydrazono]methyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[(Z)-[[(2-fluoroanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[(Z)-[(2-fluorophenyl)carbamothioylhydrazinylidene]methyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[(Z)-[(2-fluorophenyl)thiocarbamoylhydrazono]methyl]-2,3-dimethoxy-benzoic acid Formula: C17H16FN3O4S MolecularWeight: 377.390043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=NNC(=S)NC2=CC=CC=C2F)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=N\NC(=S)NC2=CC=CC=C2F)C(=O)O)OC

InChI

InChI=1S/C17H16FN3O4S/c1-24-13-8-7-10(14(16(22)23)15(13)25-2)9-19-21-17(26)20-12-6-4-3-5-11(12)18/h3-9H,1-2H3,(H,22,23)(H2,20,21,26)/b19-9-