2-methylsulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]-2-(methylthio)nicotinamide Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C18H19N3O2S/c1-24-18-15(4-2-10-19-18)17(23)20-12-13-6-8-14(9-7-13)21-11-3-5-16(21)22/h2,4,6-10H,3,5,11-12H2,1H3,(H,20,23)