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

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Formula: C26H28FN3O3S MolecularWeight: 481.582223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)F)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)F)C)C

InChI

InChI=1S/C26H28FN3O3S/c1-18-5-4-6-25(20(18)3)29-13-15-30(16-14-29)26(31)24-17-23(12-7-19(24)2)34(32,33)28-22-10-8-21(27)9-11-22/h4-12,17,28H,13-16H2,1-3H3