1-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]-3-(phenylsulfonyl)propan-1-one

Systemtic Name: 1-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]-3-(phenylsulfonyl)propan-1-one Openeye Name: 3-(benzenesulfonyl)-1-[4-[2-oxo-2-(2-thienyl)ethyl]piperazin-1-yl]propan-1-one CAS Name: 3-(benzenesulfonyl)-1-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(benzenesulfonyl)-1-[4-(2-oxo-2-thiophen-2-ylethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-besyl-1-[4-[2-keto-2-(2-thienyl)ethyl]piperazino]propan-1-one Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O4S2/c22-17(18-7-4-13-26-18)15-20-9-11-21(12-10-20)19(23)8-14-27(24,25)16-5-2-1-3-6-16/h1-7,13H,8-12,14-15H2