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

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-ethoxy-N-ethyl-3-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-4-ethoxy-N-ethyl-3-methyl-benzenesulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-4-ethoxy-N-ethyl-3-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-4-ethoxy-N-ethyl-3-methylbenzenesulfonamide Traditional Name: 4-ethoxy-N-ethyl-N-[2-keto-2-(4-piperonylpiperazino)ethyl]-3-methyl-benzenesulfonamide Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)OCC)C

Isomeric SMILES

CCN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)OCC)C

InChI

InChI=1S/C25H33N3O6S/c1-4-28(35(30,31)21-7-9-22(32-5-2)19(3)14-21)17-25(29)27-12-10-26(11-13-27)16-20-6-8-23-24(15-20)34-18-33-23/h6-9,14-15H,4-5,10-13,16-18H2,1-3H3