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

Systemtic Name: N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-3-fluoro-4-methyl-benzenesulfonamide CAS Name: N-[3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]phenyl]-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-[3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-3-fluoro-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=CC(=CC=C3)NS(=O)(=O)C4=CC(=C(C=C4)C)F)C

Isomeric SMILES

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

InChI

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