[2-[2-(diphenylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[2-(diphenylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-(2-benzhydrylidenehydrazino)-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[2-(diphenylmethylene)hydrazinyl]-2-oxoethyl] ester IUPAC Name: [2-(2-benzhydrylidenehydrazinyl)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-(N'-benzhydrylidenehydrazino)-2-keto-ethyl] ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O3S/c1-29-21-18(13-8-14-23-21)22(27)28-15-19(26)24-25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14H,15H2,1H3,(H,24,26)