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

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-N-[[1-(phenylmethyl)pyrrolidin-3-yl]methyl]benzimidazol-5-amine Openeye Name: N-[(1-benzylpyrrolidin-3-yl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-N-[[1-(phenylmethyl)-3-pyrrolidinyl]methyl]-5-benzimidazolamine IUPAC Name: N-[(1-benzylpyrrolidin-3-yl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine Traditional Name: (1-benzylpyrrolidin-3-yl)methyl-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]amine Formula: C31H33N7 MolecularWeight: 503.64062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCN(C5)CC6=CC=CC=C6

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5CCN(C5)CC6=CC=CC=C6

InChI

InChI=1S/C31H33N7/c1-23(26-10-6-3-7-11-26)35-31-32-16-14-30(36-31)38-22-34-28-18-27(12-13-29(28)38)33-19-25-15-17-37(21-25)20-24-8-4-2-5-9-24/h2-14,16,18,22-23,25,33H,15,17,19-21H2,1H3,(H,32,35,36)