4-[5-(3-nitrophenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine

Systemtic Name: 4-[5-(3-nitrophenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine Openeye Name: 4-[5-(3-nitrophenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine CAS Name: 4-[5-(3-nitrophenyl)-1-benzimidazolyl]-N-(1-phenylethyl)-2-pyrimidinamine IUPAC Name: 4-[5-(3-nitrophenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine Traditional Name: [4-[5-(3-nitrophenyl)benzimidazol-1-yl]pyrimidin-2-yl]-(1-phenylethyl)amine Formula: C25H20N6O2 MolecularWeight: 436.4653

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H20N6O2/c1-17(18-6-3-2-4-7-18)28-25-26-13-12-24(29-25)30-16-27-22-15-20(10-11-23(22)30)19-8-5-9-21(14-19)31(32)33/h2-17H,1H3,(H,26,28,29)