2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[ethyl(piperonyl)amino]-1-(4-mesylpiperazino)ethanone Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O5S/c1-3-18(11-14-4-5-15-16(10-14)25-13-24-15)12-17(21)19-6-8-20(9-7-19)26(2,22)23/h4-5,10H,3,6-9,11-13H2,1-2H3