N-[2-(4-bromophenyl)ethyl]-2-methyl-5-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: N-[2-(4-bromophenyl)ethyl]-2-methyl-5-(phenylsulfonyl)benzenesulfonamide Openeye Name: 5-(benzenesulfonyl)-N-[2-(4-bromophenyl)ethyl]-2-methyl-benzenesulfonamide CAS Name: 5-(benzenesulfonyl)-N-[2-(4-bromophenyl)ethyl]-2-methylbenzenesulfonamide IUPAC Name: 5-(benzenesulfonyl)-N-[2-(4-bromophenyl)ethyl]-2-methylbenzenesulfonamide Traditional Name: 5-besyl-N-[2-(4-bromophenyl)ethyl]-2-methyl-benzenesulfonamide Formula: C21H20BrNO4S2 MolecularWeight: 494.4218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrNO4S2/c1-16-7-12-20(28(24,25)19-5-3-2-4-6-19)15-21(16)29(26,27)23-14-13-17-8-10-18(22)11-9-17/h2-12,15,23H,13-14H2,1H3