1-[3-[[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone

Systemtic Name: 1-[3-[[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone Openeye Name: 1-[3-[[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[3-[[6-(1-benzimidazolyl)-5-nitro-4-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[[6-(benzimidazol-1-yl)-5-nitropyrimidin-4-yl]amino]phenyl]ethanone Traditional Name: 1-[3-[[6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone Formula: C19H14N6O3 MolecularWeight: 374.35286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

InChI

InChI=1S/C19H14N6O3/c1-12(26)13-5-4-6-14(9-13)23-18-17(25(27)28)19(21-10-20-18)24-11-22-15-7-2-3-8-16(15)24/h2-11H,1H3,(H,20,21,23)