[2-methoxy-4-[(E)-[(2-methoxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-[(2-methoxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-methoxy-4-[(E)-[(2-methoxyphenyl)carbamothioylhydrazono]methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-methoxy-4-[(E)-[[(2-methoxyanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(2-methoxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-methoxy-4-[(E)-[(2-methoxyphenyl)thiocarbamoylhydrazono]methyl]phenyl] ester Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NN=CC2=CC(=C(C=C2)OC(=O)C3=CN=CC=C3)OC

Isomeric SMILES

COC1=CC=CC=C1NC(=S)N/N=C/C2=CC(=C(C=C2)OC(=O)C3=CN=CC=C3)OC

InChI

InChI=1S/C22H20N4O4S/c1-28-18-8-4-3-7-17(18)25-22(31)26-24-13-15-9-10-19(20(12-15)29-2)30-21(27)16-6-5-11-23-14-16/h3-14H,1-2H3,(H2,25,26,31)/b24-13+