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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O3S/c1-19-5-2-3-6-21(19)18-28-13-15-29(16-14-28)25(30)20-7-4-8-24(17-20)33(31,32)27-23-11-9-22(26)10-12-23/h2-12,17,27H,13-16,18H2,1H3