5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-fluoranyl-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-fluoranyl-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-fluoro-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-fluoro-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-fluoro-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-fluoro-N-(4-methoxyphenyl)benzenesulfonamide Formula: C26H28FN3O4S MolecularWeight: 497.581623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28FN3O4S/c1-18-5-4-6-24(19(18)2)29-13-15-30(16-14-29)26(31)20-7-12-23(27)25(17-20)35(32,33)28-21-8-10-22(34-3)11-9-21/h4-12,17,28H,13-16H2,1-3H3