6-[4-(diethylamino)pyridin-2-yl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)pyrimidin-4-one

Systemtic Name: 6-[4-(diethylamino)pyridin-2-yl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)pyrimidin-4-one Openeye Name: 6-[4-(diethylamino)-2-pyridyl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)pyrimidin-4-one CAS Name: 6-[4-(diethylamino)-2-pyridinyl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)-4-pyrimidinone IUPAC Name: 6-[4-(diethylamino)pyridin-2-yl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)pyrimidin-4-one Traditional Name: 6-[4-(diethylamino)-2-pyridyl]-5-(4-fluorophenyl)-3-methyl-2-(3-phenylpropylamino)pyrimidin-4-one Formula: C29H32FN5O MolecularWeight: 485.595683

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC=C1)C2=C(C(=O)N(C(=N2)NCCCC3=CC=CC=C3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC)C1=CC(=NC=C1)C2=C(C(=O)N(C(=N2)NCCCC3=CC=CC=C3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C29H32FN5O/c1-4-35(5-2)24-17-19-31-25(20-24)27-26(22-13-15-23(30)16-14-22)28(36)34(3)29(33-27)32-18-9-12-21-10-7-6-8-11-21/h6-8,10-11,13-17,19-20H,4-5,9,12,18H2,1-3H3,(H,32,33)