1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-pyrimidin-4-yl-benzimidazol-5-amine

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-pyrimidin-4-yl-benzimidazol-5-amine Openeye Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-pyrimidin-4-yl-benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-N-(4-pyrimidinyl)-5-benzimidazolamine IUPAC Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-pyrimidin-4-ylbenzimidazol-5-amine Traditional Name: 1-phenylethyl-[4-[5-(4-pyrimidylamino)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C23H20N8 MolecularWeight: 408.4585

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC5=NC=NC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC5=NC=NC=C5

InChI

InChI=1S/C23H20N8/c1-16(17-5-3-2-4-6-17)28-23-25-12-10-22(30-23)31-15-27-19-13-18(7-8-20(19)31)29-21-9-11-24-14-26-21/h2-16H,1H3,(H,24,26,29)(H,25,28,30)