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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-piperonyl-3-[4-(2-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H25N3O5S2/c28-24(27-10-8-26(9-11-27)16-20-4-2-12-33-20)19-3-1-5-21(14-19)34(29,30)25-15-18-6-7-22-23(13-18)32-17-31-22/h1-7,12-14,25H,8-11,15-17H2