2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethoxyphenyl)ethanone

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethoxyphenyl)ethanone Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethoxyphenyl)ethanone CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-1-(2,5-dimethoxyphenyl)ethanone IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethoxyphenyl)ethanone Traditional Name: 2-(4-brosylpiperazino)-1-(2,5-dimethoxyphenyl)ethanone Formula: C20H23BrN2O5S MolecularWeight: 483.37602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O5S/c1-27-16-5-8-20(28-2)18(13-16)19(24)14-22-9-11-23(12-10-22)29(25,26)17-6-3-15(21)4-7-17/h3-8,13H,9-12,14H2,1-2H3