5-[4-(2-chlorophenyl)piperazin-1-yl]carbonyl-N,N-diethyl-2-fluoranyl-benzenesulfonamide

Systemtic Name: 5-[4-(2-chlorophenyl)piperazin-1-yl]carbonyl-N,N-diethyl-2-fluoranyl-benzenesulfonamide Openeye Name: 5-[4-(2-chlorophenyl)piperazine-1-carbonyl]-N,N-diethyl-2-fluoro-benzenesulfonamide CAS Name: 5-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-2-fluorobenzenesulfonamide IUPAC Name: 5-[4-(2-chlorophenyl)piperazine-1-carbonyl]-N,N-diethyl-2-fluorobenzenesulfonamide Traditional Name: 5-[4-(2-chlorophenyl)piperazine-1-carbonyl]-N,N-diethyl-2-fluoro-benzenesulfonamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3Cl)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3Cl)F

InChI

InChI=1S/C21H25ClFN3O3S/c1-3-26(4-2)30(28,29)20-15-16(9-10-18(20)23)21(27)25-13-11-24(12-14-25)19-8-6-5-7-17(19)22/h5-10,15H,3-4,11-14H2,1-2H3