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

Systemtic Name: [2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-[(E)-(carbamothioylhydrazono)methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O2S/c15-14(21)18-17-9-10-4-1-2-6-12(10)20-13(19)11-5-3-7-16-8-11/h1-9H,(H3,15,18,21)/b17-9+