2-(6-methyl-1-benzofuran-3-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(6-methyl-1-benzofuran-3-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(6-methylbenzofuran-3-yl)ethanone CAS Name: 2-(6-methyl-3-benzofuranyl)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(6-methylbenzofuran-3-yl)ethanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O4S/c1-17-7-8-20-19(15-28-21(20)13-17)14-22(25)23-9-11-24(12-10-23)29(26,27)16-18-5-3-2-4-6-18/h2-8,13,15H,9-12,14,16H2,1H3