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

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] pyridine-4-carboxylate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-2-methoxy-phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-methoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C15H14N4O3S MolecularWeight: 330.36166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)N)OC(=O)C2=CC=NC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)N)OC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H14N4O3S/c1-21-13-8-10(9-18-19-15(16)23)2-3-12(13)22-14(20)11-4-6-17-7-5-11/h2-9H,1H3,(H3,16,19,23)/b18-9+