1-[4-(phenylsulfonyl)piperazin-1-yl]-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanyl)ethanone

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanyl)ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanyl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylthio)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanyl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylthio)ethanone Formula: C20H20N6O3S2 MolecularWeight: 456.5412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NNC3=NC4=CC=CC=C4N32)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NNC3=NC4=CC=CC=C4N32)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C20H20N6O3S2/c27-18(14-30-20-23-22-19-21-16-8-4-5-9-17(16)26(19)20)24-10-12-25(13-11-24)31(28,29)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,21,22)