4-(2-methylphenyl)-N-phenethyl-6-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine

Systemtic Name: 4-(2-methylphenyl)-N-phenethyl-6-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine Openeye Name: 4-(o-tolyl)-N-phenethyl-6-[5-(4-pyridyl)benzimidazol-1-yl]-4H-pyrimidin-3-amine CAS Name: 4-(2-methylphenyl)-N-phenethyl-6-(5-pyridin-4-yl-1-benzimidazolyl)-4H-pyrimidin-3-amine IUPAC Name: 4-(2-methylphenyl)-N-phenethyl-6-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine Traditional Name: [4-(o-tolyl)-6-[5-(4-pyridyl)benzimidazol-1-yl]-4H-pyrimidin-3-yl]-phenethyl-amine Formula: C31H28N6 MolecularWeight: 484.59422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C=C(N=CN2NCCC3=CC=CC=C3)N4C=NC5=C4C=CC(=C5)C6=CC=NC=C6

Isomeric SMILES

CC1=CC=CC=C1C2C=C(N=CN2NCCC3=CC=CC=C3)N4C=NC5=C4C=CC(=C5)C6=CC=NC=C6

InChI

InChI=1S/C31H28N6/c1-23-7-5-6-10-27(23)30-20-31(34-22-37(30)35-18-13-24-8-3-2-4-9-24)36-21-33-28-19-26(11-12-29(28)36)25-14-16-32-17-15-25/h2-12,14-17,19-22,30,35H,13,18H2,1H3