N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-4-fluoro-benzenesulfonamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzenesulfonamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzenesulfonamide Traditional Name: 4-fluoro-N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]benzenesulfonamide Formula: C23H28FN3O5S MolecularWeight: 477.548923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H28FN3O5S/c1-16(2)22(25-33(29,30)19-6-4-18(24)5-7-19)23(28)27-11-9-26(10-12-27)14-17-3-8-20-21(13-17)32-15-31-20/h3-8,13,16,22,25H,9-12,14-15H2,1-2H3