[1-oxidanylidene-1-[(2-phenylsulfanylphenyl)amino]propan-2-yl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(2-phenylsulfanylphenyl)amino]propan-2-yl] 6-chloranylpyridine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-phenylsulfanylanilino)ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [1-oxo-1-[2-(phenylthio)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(2-phenylsulfanylanilino)propan-2-yl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid [2-keto-1-methyl-2-[2-(phenylthio)anilino]ethyl] ester Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)OC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)OC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O3S/c1-14(27-21(26)15-11-12-19(22)23-13-15)20(25)24-17-9-5-6-10-18(17)28-16-7-3-2-4-8-16/h2-14H,1H3,(H,24,25)