2-[(2-azanyl-3-phenyl-propyl)amino]-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[(2-azanyl-3-phenyl-propyl)amino]-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[(2-amino-3-phenyl-propyl)amino]-5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[(2-amino-3-phenylpropyl)amino]-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[(2-amino-3-phenylpropyl)amino]-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[(2-amino-3-phenyl-propyl)amino]-5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C25H24FN5O MolecularWeight: 429.489363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1NCC(CC2=CC=CC=C2)N)C3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C(=O)C(=C(N=C1NCC(CC2=CC=CC=C2)N)C3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN5O/c1-31-24(32)22(18-7-9-20(26)10-8-18)23(19-11-13-28-14-12-19)30-25(31)29-16-21(27)15-17-5-3-2-4-6-17/h2-14,21H,15-16,27H2,1H3,(H,29,30)