N-[[1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-4-yl]methyl]-3-piperidin-1-yl-propan-1-amine

Systemtic Name: N-[[1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-4-yl]methyl]-3-piperidin-1-yl-propan-1-amine Openeye Name: N-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydrobenzothiophen-4-yl]methyl]-3-(1-piperidyl)propan-1-amine CAS Name: N-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydro-1-benzothiophen-4-yl]methyl]-3-(1-piperidinyl)-1-propanamine IUPAC Name: N-[[3-(benzenesulfonyl)-1,1-dioxo-2,3-dihydro-1-benzothiophen-4-yl]methyl]-3-piperidin-1-ylpropan-1-amine Traditional Name: (3-besyl-1,1-diketo-2,3-dihydrobenzothiophen-4-yl)methyl-(3-piperidinopropyl)amine Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNCC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCCNCC2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H30N2O4S2/c26-30(27)18-22(31(28,29)20-10-3-1-4-11-20)23-19(9-7-12-21(23)30)17-24-13-8-16-25-14-5-2-6-15-25/h1,3-4,7,9-12,22,24H,2,5-6,8,13-18H2