(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(4-chlorophenyl)thio]-3-pyridinecarboxylic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-(4-chlorophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(4-chlorophenyl)thio]nicotinic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=C(N=CC=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=C(N=CC=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O3S/c19-13-5-7-14(8-6-13)25-17-15(4-3-9-20-17)18(23)24-12-16(22)21-10-1-2-11-21/h3-9H,1-2,10-12H2