[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(2-chlorophenyl)thio]-3-pyridinecarboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(2-chlorophenyl)thio]nicotinic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C18H13ClN2O3S MolecularWeight: 372.82542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SC2=C(C=CC=N2)C(=O)OCC(=O)C3=CC=CN3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SC2=C(C=CC=N2)C(=O)OCC(=O)C3=CC=CN3)Cl

InChI

InChI=1S/C18H13ClN2O3S/c19-13-6-1-2-8-16(13)25-17-12(5-3-10-21-17)18(23)24-11-15(22)14-7-4-9-20-14/h1-10,20H,11H2