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

Systemtic Name: N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine Openeye Name: N-[(1-isobutylpyrrolidin-2-yl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine CAS Name: N-[[1-(2-methylpropyl)-2-pyrrolidinyl]methyl]-1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolamine IUPAC Name: N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine Traditional Name: (1-isobutylpyrrolidin-2-yl)methyl-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]amine Formula: C28H35N7 MolecularWeight: 469.6244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCCC1CNC2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5

Isomeric SMILES

CC(C)CN1CCCC1CNC2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5

InChI

InChI=1S/C28H35N7/c1-20(2)18-34-15-7-10-24(34)17-30-23-11-12-26-25(16-23)31-19-35(26)27-13-14-29-28(33-27)32-21(3)22-8-5-4-6-9-22/h4-6,8-9,11-14,16,19-21,24,30H,7,10,15,17-18H2,1-3H3,(H,29,32,33)