5-(4-fluorophenyl)-6-pyridin-4-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-6-pyridin-4-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-6-(4-pyridyl)-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-6-pyridin-4-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-6-pyridin-4-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-6-(4-pyridyl)-2-(1,2,3,4-tetrahydroisoquinolin-3-ylmethylamino)-1H-pyrimidin-4-one Formula: C25H22FN5O MolecularWeight: 427.473483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=CC=CC=C21)CNC3=NC(=O)C(=C(N3)C4=CC=NC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1C(NCC2=CC=CC=C21)CNC3=NC(=O)C(=C(N3)C4=CC=NC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FN5O/c26-20-7-5-16(6-8-20)22-23(17-9-11-27-12-10-17)30-25(31-24(22)32)29-15-21-13-18-3-1-2-4-19(18)14-28-21/h1-12,21,28H,13-15H2,(H2,29,30,31,32)