N-[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-5-amine

Systemtic Name: N-[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-5-amine Openeye Name: N-[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-5-amine CAS Name: N-[6-(1-benzimidazolyl)-5-nitro-4-pyrimidinyl]-5-quinolinamine IUPAC Name: N-[6-(benzimidazol-1-yl)-5-nitropyrimidin-4-yl]quinolin-5-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-(5-quinolyl)amine Formula: C20H13N7O2 MolecularWeight: 383.36292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NC4=CC=CC5=C4C=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NC4=CC=CC5=C4C=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C20H13N7O2/c28-27(29)18-19(25-15-8-3-7-14-13(15)5-4-10-21-14)22-11-23-20(18)26-12-24-16-6-1-2-9-17(16)26/h1-12H,(H,22,23,25)