4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide Formula: C20H21ClFN3O4S MolecularWeight: 453.914843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClFN3O4S/c1-23(2)30(28,29)16-6-3-14(4-7-16)19(26)24-9-11-25(12-10-24)20(27)17-13-15(21)5-8-18(17)22/h3-8,13H,9-12H2,1-2H3