4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-N-(2-fluorophenyl)benzenesulfonamide

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-N-(2-fluorophenyl)benzenesulfonamide Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-(2-fluorophenyl)benzenesulfonamide CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-N-(2-fluorophenyl)benzenesulfonamide IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-(2-fluorophenyl)benzenesulfonamide Traditional Name: N-(2-fluorophenyl)-4-(4-piperonylpiperazine-1-carbonyl)benzenesulfonamide Formula: C25H24FN3O5S MolecularWeight: 497.538563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5F

InChI

InChI=1S/C25H24FN3O5S/c26-21-3-1-2-4-22(21)27-35(31,32)20-8-6-19(7-9-20)25(30)29-13-11-28(12-14-29)16-18-5-10-23-24(15-18)34-17-33-23/h1-10,15,27H,11-14,16-17H2