6-cyclopropyl-2-methylsulfanyl-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide

Systemtic Name: 6-cyclopropyl-2-methylsulfanyl-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide Openeye Name: 6-cyclopropyl-2-methylsulfanyl-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide CAS Name: 6-cyclopropyl-2-(methylthio)-N-[[2-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]-4-pyrimidinecarboxamide IUPAC Name: 6-cyclopropyl-2-methylsulfanyl-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide Traditional Name: 6-cyclopropyl-N-[2-[(2-ketopyrrolidino)methyl]benzyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)C2CC2)C(=O)NCC3=CC=CC=C3CN4CCCC4=O

Isomeric SMILES

CSC1=NC(=CC(=N1)C2CC2)C(=O)NCC3=CC=CC=C3CN4CCCC4=O

InChI

InChI=1S/C21H24N4O2S/c1-28-21-23-17(14-8-9-14)11-18(24-21)20(27)22-12-15-5-2-3-6-16(15)13-25-10-4-7-19(25)26/h2-3,5-6,11,14H,4,7-10,12-13H2,1H3,(H,22,27)