N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: 3-(4-mesylpiperazine-1-carbonyl)-N-piperonyl-benzenesulfonamide Formula: C20H23N3O7S2 MolecularWeight: 481.54252

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H23N3O7S2/c1-31(25,26)23-9-7-22(8-10-23)20(24)16-3-2-4-17(12-16)32(27,28)21-13-15-5-6-18-19(11-15)30-14-29-18/h2-6,11-12,21H,7-10,13-14H2,1H3