1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-3-ylmethyl)benzimidazol-5-amine

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-3-ylmethyl)benzimidazol-5-amine Openeye Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-3-ylmethyl)benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-N-(3-pyrrolidinylmethyl)-5-benzimidazolamine IUPAC Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(pyrrolidin-3-ylmethyl)benzimidazol-5-amine Traditional Name: 1-phenylethyl-[4-[5-(pyrrolidin-3-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)NCC5CCNC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCNC5

InChI

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