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

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-2-ylmethyl)benzimidazol-5-amine Openeye Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-2-ylmethyl)benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-N-(2-pyrrolidinylmethyl)-5-benzimidazolamine IUPAC Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-2-ylmethyl)benzimidazol-5-amine Traditional Name: 1-phenylethyl-[4-[5-(pyrrolidin-2-ylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C24H27N7 MolecularWeight: 413.51808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCCN5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCCN5

InChI

InChI=1S/C24H27N7/c1-17(18-6-3-2-4-7-18)29-24-26-13-11-23(30-24)31-16-28-21-14-19(9-10-22(21)31)27-15-20-8-5-12-25-20/h2-4,6-7,9-11,13-14,16-17,20,25,27H,5,8,12,15H2,1H3,(H,26,29,30)