4-chloranyl-N,N-diethyl-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-diethyl-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N,N-diethyl-3-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-chloro-N,N-diethyl-3-[[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-diethyl-3-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-chloro-N,N-diethyl-3-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C22H25ClFN3O4S MolecularWeight: 481.968003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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