2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyridine-3-carboxamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NC3=CC=CC(=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NC3=CC=CC(=C3)N4CCCC4=O

InChI

InChI=1S/C21H20N4O3S/c1-14-11-16(24-28-14)13-29-21-18(7-3-9-22-21)20(27)23-15-5-2-6-17(12-15)25-10-4-8-19(25)26/h2-3,5-7,9,11-12H,4,8,10,13H2,1H3,(H,23,27)