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

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolamine IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-amine Traditional Name: (2,4-dimethoxybenzyl)-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]amine Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5=C(C=C(C=C5)OC)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NCC5=C(C=C(C=C5)OC)OC

InChI

InChI=1S/C28H28N6O2/c1-19(20-7-5-4-6-8-20)32-28-29-14-13-27(33-28)34-18-31-24-15-22(10-12-25(24)34)30-17-21-9-11-23(35-2)16-26(21)36-3/h4-16,18-19,30H,17H2,1-3H3,(H,29,32,33)