4-bromanyl-N-(1-methylbenzimidazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(1-methylbenzimidazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-(1-methylbenzimidazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(1-methyl-2-benzimidazolyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(1-methylbenzimidazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-(1-methylbenzimidazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H9BrN6O3 MolecularWeight: 365.14226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

Isomeric SMILES

CN1C2=CC=CC=C2N=C1NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

InChI

InChI=1S/C12H9BrN6O3/c1-18-7-5-3-2-4-6(7)14-12(18)15-11(20)9-8(13)10(17-16-9)19(21)22/h2-5H,1H3,(H,16,17)(H,14,15,20)