(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-phenylsulfanylpyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-phenylsulfanylpyridine-3-carboxylate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-phenylsulfanylpyridine-3-carboxylate CAS Name: 2-(phenylthio)-3-pyridinecarboxylic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-phenylsulfanylpyridine-3-carboxylate Traditional Name: 2-(phenylthio)nicotinic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3S/c21-16(20-11-4-5-12-20)13-23-18(22)15-9-6-10-19-17(15)24-14-7-2-1-3-8-14/h1-3,6-10H,4-5,11-13H2