[4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Openeye Name: [4-[(Z)-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylhydrazono]methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(Z)-[[[[(2R)-2-oxolanyl]methylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(Z)-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylhydrazono]methyl]phenyl] ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NN=CC2=CC=C(C=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)N/N=C\C2=CC=C(C=C2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H20N4O3S/c24-18(15-3-1-9-20-12-15)26-16-7-5-14(6-8-16)11-22-23-19(27)21-13-17-4-2-10-25-17/h1,3,5-9,11-12,17H,2,4,10,13H2,(H2,21,23,27)/b22-11-/t17-/m1/s1