1-ethyl-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]benzimidazole-2-thione

Systemtic Name: 1-ethyl-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]benzimidazole-2-thione Openeye Name: 1-ethyl-3-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]benzimidazole-2-thione CAS Name: 1-ethyl-3-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]-2-benzimidazolethione IUPAC Name: 1-ethyl-3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]benzimidazole-2-thione Traditional Name: 1-ethyl-3-[[4-(6-nitro-3-pyridyl)piperazino]methyl]benzimidazole-2-thione Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=S)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=S)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O2S/c1-2-23-16-5-3-4-6-17(16)24(19(23)28)14-21-9-11-22(12-10-21)15-7-8-18(20-13-15)25(26)27/h3-8,13H,2,9-12,14H2,1H3