5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethylideneamino]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethylideneamino]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethyleneamino]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethylideneamino]-4-pyrimidinone IUPAC Name: 5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethylideneamino]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)-2-[(E)-1,2,3,4-tetrahydroisoquinolin-3-ylmethyleneamino]pyrimidin-4-one Formula: C26H22FN5O MolecularWeight: 439.484183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1N=CC2CC3=CC=CC=C3CN2)C4=CC=NC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C(=O)C(=C(N=C1/N=C/C2CC3=CC=CC=C3CN2)C4=CC=NC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN5O/c1-32-25(33)23(17-6-8-21(27)9-7-17)24(18-10-12-28-13-11-18)31-26(32)30-16-22-14-19-4-2-3-5-20(19)15-29-22/h2-13,16,22,29H,14-15H2,1H3/b30-16+