1-[4-(phenylsulfonyl)piperazin-1-yl]-4-thiophen-2-yl-butan-1-one

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]-4-thiophen-2-yl-butan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2-thienyl)butan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-4-thiophen-2-yl-1-butanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-thiophen-2-ylbutan-1-one Traditional Name: 1-(4-besylpiperazino)-4-(2-thienyl)butan-1-one Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCC2=CC=CS2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCCC2=CC=CS2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O3S2/c21-18(10-4-6-16-7-5-15-24-16)19-11-13-20(14-12-19)25(22,23)17-8-2-1-3-9-17/h1-3,5,7-9,15H,4,6,10-14H2