2-[[2-(1,4-benzodioxin-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[2-(1,4-benzodioxin-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[[2-(1,4-benzodioxin-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[2-(1,4-benzodioxin-3-yl)phenyl]methylsulfinyl]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[[2-(1,4-benzodioxin-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[2-(1,4-benzodioxin-3-yl)benzyl]sulfinyl-1-(4-methylpiperazino)ethanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CS(=O)CC2=CC=CC=C2C3=COC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)C(=O)CS(=O)CC2=CC=CC=C2C3=COC4=CC=CC=C4O3

InChI

InChI=1S/C22H24N2O4S/c1-23-10-12-24(13-11-23)22(25)16-29(26)15-17-6-2-3-7-18(17)21-14-27-19-8-4-5-9-20(19)28-21/h2-9,14H,10-13,15-16H2,1H3