N-(1-phenylethyl)-4-(5-purin-4-ylbenzimidazol-1-yl)pyrimidin-2-amine

Systemtic Name: N-(1-phenylethyl)-4-(5-purin-4-ylbenzimidazol-1-yl)pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-(5-purin-4-ylbenzimidazol-1-yl)pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[5-(4-purinyl)-1-benzimidazolyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-(5-purin-4-ylbenzimidazol-1-yl)pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-(5-purin-4-ylbenzimidazol-1-yl)pyrimidin-2-yl]amine Formula: C24H19N9 MolecularWeight: 433.46796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C56C(=NC=N5)C=NC=N6

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C56C(=NC=N5)C=NC=N6

InChI

InChI=1S/C24H19N9/c1-16(17-5-3-2-4-6-17)31-23-26-10-9-22(32-23)33-15-28-19-11-18(7-8-20(19)33)24-21(27-14-30-24)12-25-13-29-24/h2-16H,1H3,(H,26,31,32)