N-[2-(3-bromanylpiperazin-1-yl)-2-(4-propan-2-ylsulfonylphenyl)ethyl]benzenesulfonamide

Systemtic Name: N-[2-(3-bromanylpiperazin-1-yl)-2-(4-propan-2-ylsulfonylphenyl)ethyl]benzenesulfonamide Openeye Name: N-[2-(3-bromopiperazin-1-yl)-2-(4-isopropylsulfonylphenyl)ethyl]benzenesulfonamide CAS Name: N-[2-(3-bromo-1-piperazinyl)-2-(4-propan-2-ylsulfonylphenyl)ethyl]benzenesulfonamide IUPAC Name: N-[2-(3-bromopiperazin-1-yl)-2-(4-propan-2-ylsulfonylphenyl)ethyl]benzenesulfonamide Traditional Name: N-[2-(3-bromopiperazino)-2-(4-isopropylsulfonylphenyl)ethyl]benzenesulfonamide Formula: C21H28BrN3O4S2 MolecularWeight: 530.49872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)Br

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)Br

InChI

InChI=1S/C21H28BrN3O4S2/c1-16(2)30(26,27)18-10-8-17(9-11-18)20(25-13-12-23-21(22)15-25)14-24-31(28,29)19-6-4-3-5-7-19/h3-11,16,20-21,23-24H,12-15H2,1-2H3