4-fluoranyl-N-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonylphenyl]benzenesulfonamide

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

Isomeric SMILES

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

InChI

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