2-[3-azanyl-6-(4-methylphenyl)-2-phenylazanyl-4H-pyrimidin-4-yl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[3-azanyl-6-(4-methylphenyl)-2-phenylazanyl-4H-pyrimidin-4-yl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[3-amino-2-anilino-6-(p-tolyl)-4H-pyrimidin-4-yl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[3-amino-2-anilino-6-(4-methylphenyl)-4H-pyrimidin-4-yl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[3-amino-2-anilino-6-(4-methylphenyl)-4H-pyrimidin-4-yl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[3-amino-2-anilino-6-(p-tolyl)-4H-pyrimidin-4-yl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(N(C(=N2)NC3=CC=CC=C3)N)C4C(=O)CC(CC4=O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(N(C(=N2)NC3=CC=CC=C3)N)C4C(=O)CC(CC4=O)(C)C

InChI

InChI=1S/C25H28N4O2/c1-16-9-11-17(12-10-16)19-13-20(23-21(30)14-25(2,3)15-22(23)31)29(26)24(28-19)27-18-7-5-4-6-8-18/h4-13,20,23H,14-15,26H2,1-3H3,(H,27,28)