6-(benzimidazol-1-yl)-5-nitro-N-pyridin-3-yl-pyrimidin-4-amine

Systemtic Name: 6-(benzimidazol-1-yl)-5-nitro-N-pyridin-3-yl-pyrimidin-4-amine Openeye Name: 6-(benzimidazol-1-yl)-5-nitro-N-(3-pyridyl)pyrimidin-4-amine CAS Name: 6-(1-benzimidazolyl)-5-nitro-N-(3-pyridinyl)-4-pyrimidinamine IUPAC Name: 6-(benzimidazol-1-yl)-5-nitro-N-pyridin-3-ylpyrimidin-4-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-(3-pyridyl)amine Formula: C16H11N7O2 MolecularWeight: 333.30424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N7O2/c24-23(25)14-15(21-11-4-3-7-17-8-11)18-9-19-16(14)22-10-20-12-5-1-2-6-13(12)22/h1-10H,(H,18,19,21)