2-[(4-fluorophenyl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-fluorophenyl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Openeye Name: 2-(4-fluoroanilino)-5-isopentyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(4-fluoroanilino)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-fluoroanilino)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Traditional Name: 2-(4-fluoroanilino)-5-isoamyl-6-methyl-1H-pyrimidin-4-one Formula: C16H20FN3O MolecularWeight: 289.347903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC2=CC=C(C=C2)F)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC2=CC=C(C=C2)F)CCC(C)C

InChI

InChI=1S/C16H20FN3O/c1-10(2)4-9-14-11(3)18-16(20-15(14)21)19-13-7-5-12(17)6-8-13/h5-8,10H,4,9H2,1-3H3,(H2,18,19,20,21)