2-[[1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-4-yl]methylamino]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-4-yl]methylamino]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydrobenzothiophen-4-yl]methylamino]-1-(1-piperidyl)ethanone CAS Name: 2-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydro-1-benzothiophen-4-yl]methylamino]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydro-1-benzothiophen-4-yl]methylamino]-1-piperidin-1-ylethanone Traditional Name: 2-[(3-besyl-1,1-diketo-2,3-dihydrobenzothiophen-4-yl)methylamino]-1-piperidino-ethanone Formula: C22H26N2O5S2 MolecularWeight: 462.58224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CNCC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CNCC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O5S2/c25-21(24-12-5-2-6-13-24)15-23-14-17-8-7-11-19-22(17)20(16-30(19,26)27)31(28,29)18-9-3-1-4-10-18/h1,3-4,7-11,20,23H,2,5-6,12-16H2