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

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(piperidin-3-ylmethyl)benzimidazol-5-amine Openeye Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(3-piperidylmethyl)benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-N-(3-piperidinylmethyl)-5-benzimidazolamine IUPAC Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-(piperidin-3-ylmethyl)benzimidazol-5-amine Traditional Name: 1-phenylethyl-[4-[5-(3-piperidylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C25H29N7 MolecularWeight: 427.54466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCCNC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCCNC5

InChI

InChI=1S/C25H29N7/c1-18(20-7-3-2-4-8-20)30-25-27-13-11-24(31-25)32-17-29-22-14-21(9-10-23(22)32)28-16-19-6-5-12-26-15-19/h2-4,7-11,13-14,17-19,26,28H,5-6,12,15-16H2,1H3,(H,27,30,31)