2-bromanyl-5-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 2-bromanyl-5-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 2-bromo-5-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 2-bromo-5-[[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 2-bromo-5-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 2-bromo-5-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide Formula: C20H21BrFN3O4S MolecularWeight: 498.365843

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F)Br

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F)Br

InChI

InChI=1S/C20H21BrFN3O4S/c1-23(2)30(28,29)18-13-15(6-7-17(18)21)20(27)25-10-8-24(9-11-25)19(26)14-4-3-5-16(22)12-14/h3-7,12-13H,8-11H2,1-2H3