2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-(3,3-dimethylbutylamino)-5-(4-fluorophenyl)-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C22H25FN4O MolecularWeight: 380.458503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCNC1=NC(=C(C(=O)N1C)C2=CC=C(C=C2)F)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)CCNC1=NC(=C(C(=O)N1C)C2=CC=C(C=C2)F)C3=CC=NC=C3

InChI

InChI=1S/C22H25FN4O/c1-22(2,3)11-14-25-21-26-19(16-9-12-24-13-10-16)18(20(28)27(21)4)15-5-7-17(23)8-6-15/h5-10,12-13H,11,14H2,1-4H3,(H,25,26)