N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-isopropylsulfanyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyridine-3-carboxamide CAS Name: N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-(propan-2-ylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propan-2-ylsulfanylpyridine-3-carboxamide Traditional Name: 2-(isopropylthio)-N-[4-(2-ketopyrrolidino)phenyl]nicotinamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC=N1)C(=O)NC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC(C)SC1=C(C=CC=N1)C(=O)NC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C19H21N3O2S/c1-13(2)25-19-16(5-3-11-20-19)18(24)21-14-7-9-15(10-8-14)22-12-4-6-17(22)23/h3,5,7-11,13H,4,6,12H2,1-2H3,(H,21,24)