1-[6-(3-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[6-(3-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(3-methyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[6-(3-methyl-1-piperidinyl)-5-nitro-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[6-(3-methylpiperidin-1-yl)-5-nitropyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-(3-methylpiperidino)-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

Isomeric SMILES

CC1CCCN(C1)C2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

InChI

InChI=1S/C17H18N6O2/c1-12-5-4-8-21(9-12)16-15(23(24)25)17(19-10-18-16)22-11-20-13-6-2-3-7-14(13)22/h2-3,6-7,10-12H,4-5,8-9H2,1H3