N-(2-nitro-1-phenyl-ethyl)-4-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine

Systemtic Name: N-(2-nitro-1-phenyl-ethyl)-4-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine Openeye Name: N-(2-nitro-1-phenyl-ethyl)-4-[5-(4-pyridyl)benzimidazol-1-yl]-4H-pyrimidin-3-amine CAS Name: N-(2-nitro-1-phenylethyl)-4-(5-pyridin-4-yl-1-benzimidazolyl)-4H-pyrimidin-3-amine IUPAC Name: N-(2-nitro-1-phenylethyl)-4-(5-pyridin-4-ylbenzimidazol-1-yl)-4H-pyrimidin-3-amine Traditional Name: (2-nitro-1-phenyl-ethyl)-[4-[5-(4-pyridyl)benzimidazol-1-yl]-4H-pyrimidin-3-yl]amine Formula: C24H21N7O2 MolecularWeight: 439.46924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+](=O)[O-])NN2C=NC=CC2N3C=NC4=C3C=CC(=C4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+](=O)[O-])NN2C=NC=CC2N3C=NC4=C3C=CC(=C4)C5=CC=NC=C5

InChI

InChI=1S/C24H21N7O2/c32-31(33)15-22(19-4-2-1-3-5-19)28-30-16-26-13-10-24(30)29-17-27-21-14-20(6-7-23(21)29)18-8-11-25-12-9-18/h1-14,16-17,22,24,28H,15H2