3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N,N-diethyl-4-fluoranyl-benzenesulfonamide

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N,N-diethyl-4-fluoranyl-benzenesulfonamide Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-fluoro-benzenesulfonamide CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-4-fluorobenzenesulfonamide IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-fluorobenzenesulfonamide Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-fluoro-benzenesulfonamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C23H30FN3O3S/c1-5-27(6-2)31(29,30)19-10-11-21(24)20(16-19)23(28)26-14-12-25(13-15-26)22-9-7-8-17(3)18(22)4/h7-11,16H,5-6,12-15H2,1-4H3