2-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[4-[2-(4-bromophenyl)sulfonylethyl]-1-piperazinyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[4-(2-brosylethyl)piperazino]-N-(2,3-dimethylphenyl)acetamide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CCS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CCS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H28BrN3O3S/c1-17-4-3-5-21(18(17)2)24-22(27)16-26-12-10-25(11-13-26)14-15-30(28,29)20-8-6-19(23)7-9-20/h3-9H,10-16H2,1-2H3,(H,24,27)