2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-1-[4-(2-thienylsulfonyl)piperazino]ethanone Formula: C18H20N4O3S3 MolecularWeight: 436.5714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CSCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H20N4O3S3/c23-17(13-26-12-16-19-14-4-1-2-5-15(14)20-16)21-7-9-22(10-8-21)28(24,25)18-6-3-11-27-18/h1-6,11H,7-10,12-13H2,(H,19,20)