3-methyl-5-(4-methylsulfanylphenyl)-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-5-(4-methylsulfanylphenyl)-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-methyl-5-(4-methylsulfanylphenyl)-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-5-[4-(methylthio)phenyl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-5-(4-methylsulfanylphenyl)-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-methyl-2-[methyl(1,2,3,4-tetrahydroisoquinolin-1-yl)amino]-5-[4-(methylthio)phenyl]-6-(4-pyridyl)pyrimidin-4-one Formula: C27H27N5OS MolecularWeight: 469.60118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1N(C)C2C3=CC=CC=C3CCN2)C4=CC=NC=C4)C5=CC=C(C=C5)SC

Isomeric SMILES

CN1C(=O)C(=C(N=C1N(C)C2C3=CC=CC=C3CCN2)C4=CC=NC=C4)C5=CC=C(C=C5)SC

InChI

InChI=1S/C27H27N5OS/c1-31(25-22-7-5-4-6-18(22)14-17-29-25)27-30-24(20-12-15-28-16-13-20)23(26(33)32(27)2)19-8-10-21(34-3)11-9-19/h4-13,15-16,25,29H,14,17H2,1-3H3