1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-thiophen-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-thiophen-2-ylsulfanyl-ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-thienylsulfanyl)ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-(thiophen-2-ylthio)ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-thiophen-2-ylsulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(2-thienylthio)ethanone Formula: C17H20N2O3S3 MolecularWeight: 396.5473

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=CS2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=CS2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N2O3S3/c20-16(13-24-17-7-4-12-23-17)18-8-10-19(11-9-18)25(21,22)14-15-5-2-1-3-6-15/h1-7,12H,8-11,13-14H2