2-[3-azanyl-6-(4-methylphenyl)-2-phenylazanyl-4H-pyrimidin-4-yl]-1-phenyl-butane-1,3-dione

Systemtic Name: 2-[3-azanyl-6-(4-methylphenyl)-2-phenylazanyl-4H-pyrimidin-4-yl]-1-phenyl-butane-1,3-dione Openeye Name: 2-[3-amino-2-anilino-6-(p-tolyl)-4H-pyrimidin-4-yl]-1-phenyl-butane-1,3-dione CAS Name: 2-[3-amino-2-anilino-6-(4-methylphenyl)-4H-pyrimidin-4-yl]-1-phenylbutane-1,3-dione IUPAC Name: 2-[3-amino-2-anilino-6-(4-methylphenyl)-4H-pyrimidin-4-yl]-1-phenylbutane-1,3-dione Traditional Name: 2-[3-amino-2-anilino-6-(p-tolyl)-4H-pyrimidin-4-yl]-1-phenyl-butane-1,3-dione Formula: C27H26N4O2 MolecularWeight: 438.52094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(N(C(=N2)NC3=CC=CC=C3)N)C(C(=O)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(N(C(=N2)NC3=CC=CC=C3)N)C(C(=O)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-18-13-15-20(16-14-18)23-17-24(25(19(2)32)26(33)21-9-5-3-6-10-21)31(28)27(30-23)29-22-11-7-4-8-12-22/h3-17,24-25H,28H2,1-2H3,(H,29,30)