3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[4-(2-ketopyrrolidino)benzyl]propionamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H26N4O2S/c1-14-18(15(2)24-21(23-14)28-3)10-11-19(26)22-13-16-6-8-17(9-7-16)25-12-4-5-20(25)27/h6-9H,4-5,10-13H2,1-3H3,(H,22,26)