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

Systemtic Name: [4-[(Z)-(butylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] pyridine-4-carboxylate Openeye Name: [4-[(Z)-(butylcarbamothioylhydrazono)methyl]-2-methoxy-phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(Z)-[[butylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-(butylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[(Z)-(butylthiocarbamoylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC(=C(C=C1)OC(=O)C2=CC=NC=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O3S/c1-3-4-9-21-19(27)23-22-13-14-5-6-16(17(12-14)25-2)26-18(24)15-7-10-20-11-8-15/h5-8,10-13H,3-4,9H2,1-2H3,(H2,21,23,27)/b22-13-