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

Systemtic Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-2-methylphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methylphenyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-4-methyl-benzenesulfonamide Formula: C25H26FN3O3S MolecularWeight: 467.555643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O3S/c1-18-6-12-22(13-7-18)33(31,32)27-24-5-3-4-23(19(24)2)25(30)29-16-14-28(15-17-29)21-10-8-20(26)9-11-21/h3-13,27H,14-17H2,1-2H3