3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-1-propanone IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS/c1-15-19(16(2)23-21(22-15)26-3)9-10-20(25)24-13-11-18(12-14-24)17-7-5-4-6-8-17/h4-8,11H,9-10,12-14H2,1-3H3