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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[(6-pyrrolidino-3-pyridyl)methyl]propionamide Formula: C20H27N5OS MolecularWeight: 385.52628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5OS/c1-14-17(15(2)24-20(23-14)27-3)7-9-19(26)22-13-16-6-8-18(21-12-16)25-10-4-5-11-25/h6,8,12H,4-5,7,9-11,13H2,1-3H3,(H,22,26)