5-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-N,N,2,3-tetramethyl-benzenesulfonamide

Systemtic Name: 5-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-N,N,2,3-tetramethyl-benzenesulfonamide Openeye Name: 5-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-N,N,2,3-tetramethyl-benzenesulfonamide CAS Name: 5-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-N,N,2,3-tetramethylbenzenesulfonamide IUPAC Name: 5-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]-N,N,2,3-tetramethylbenzenesulfonamide Traditional Name: 5-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-N,N,2,3-tetramethyl-benzenesulfonamide Formula: C22H25ClFN3O4S MolecularWeight: 481.968003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C22H25ClFN3O4S/c1-14-11-16(12-20(15(14)2)32(30,31)25(3)4)21(28)26-7-9-27(10-8-26)22(29)18-13-17(23)5-6-19(18)24/h5-6,11-13H,7-10H2,1-4H3