[2-methoxy-4-[(Z)-(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(Z)-(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-methoxy-4-[(Z)-(2-methoxyethylcarbamothioylhydrazono)methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-methoxy-4-[(Z)-[[(2-methoxyethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-methoxy-4-[(Z)-(2-methoxyethylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC

Isomeric SMILES

COCCNC(=S)N/N=C\C1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC

InChI

InChI=1S/C18H20N4O4S/c1-24-9-8-20-18(27)22-21-11-13-5-6-15(16(10-13)25-2)26-17(23)14-4-3-7-19-12-14/h3-7,10-12H,8-9H2,1-2H3,(H2,20,22,27)/b21-11-