1-ethyl-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-2-thione

Systemtic Name: 1-ethyl-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-2-thione Openeye Name: 1-ethyl-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-2-thione CAS Name: 1-ethyl-3-[[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-2-benzimidazolethione IUPAC Name: 1-ethyl-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-2-thione Traditional Name: 1-ethyl-3-[[4-(2-nitrophenyl)sulfonylpiperazino]methyl]benzimidazole-2-thione Formula: C20H23N5O4S2 MolecularWeight: 461.55772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O4S2/c1-2-23-16-7-3-4-8-17(16)24(20(23)30)15-21-11-13-22(14-12-21)31(28,29)19-10-6-5-9-18(19)25(26)27/h3-10H,2,11-15H2,1H3