3-(phenylsulfonyl)-4-(piperazin-1-ylmethyl)-2,3-dihydro-1-benzothiophene 1,1-dioxide

Systemtic Name: 3-(phenylsulfonyl)-4-(piperazin-1-ylmethyl)-2,3-dihydro-1-benzothiophene 1,1-dioxide Openeye Name: 3-(benzenesulfonyl)-4-(piperazin-1-ylmethyl)-2,3-dihydrobenzothiophene 1,1-dioxide CAS Name: 3-(benzenesulfonyl)-4-(1-piperazinylmethyl)-2,3-dihydro-1-benzothiophene 1,1-dioxide IUPAC Name: 3-(benzenesulfonyl)-4-(piperazin-1-ylmethyl)-2,3-dihydro-1-benzothiophene 1,1-dioxide Traditional Name: 3-besyl-4-(piperazinomethyl)-2,3-dihydrobenzothiophene 1,1-dioxide Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)CC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

InChI

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