2-(5,6-dimethyl-1-benzofuran-3-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5,6-dimethyl-1-benzofuran-3-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(5,6-dimethylbenzofuran-3-yl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(5,6-dimethyl-3-benzofuranyl)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(5,6-dimethyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(5,6-dimethylbenzofuran-3-yl)ethanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N2O4S/c1-16-12-20-18(15-28-21(20)13-17(16)2)14-22(25)23-8-10-24(11-9-23)29(26,27)19-6-4-3-5-7-19/h3-7,12-13,15H,8-11,14H2,1-2H3