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

Systemtic Name: 2-[[3-(1-benzothiophen-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[[3-(benzothiophen-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[3-(1-benzothiophen-3-yl)phenyl]methylsulfinyl]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[[3-(1-benzothiophen-3-yl)phenyl]methylsulfinyl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[3-(benzothiophen-3-yl)benzyl]sulfinyl-1-(4-methylpiperazino)ethanone Formula: C22H24N2O2S2 MolecularWeight: 412.56816

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CS(=O)CC2=CC=CC(=C2)C3=CSC4=CC=CC=C43

Isomeric SMILES

CN1CCN(CC1)C(=O)CS(=O)CC2=CC=CC(=C2)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C22H24N2O2S2/c1-23-9-11-24(12-10-23)22(25)16-28(26)15-17-5-4-6-18(13-17)20-14-27-21-8-3-2-7-19(20)21/h2-8,13-14H,9-12,15-16H2,1H3