2-[[3-(1-benzofuran-2-yl)phenyl]methylsulfinyl]-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[3-(1-benzofuran-2-yl)phenyl]methylsulfinyl]-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[[3-(benzofuran-2-yl)phenyl]methylsulfinyl]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[[3-(2-benzofuranyl)phenyl]methylsulfinyl]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[[3-(1-benzofuran-2-yl)phenyl]methylsulfinyl]ethanone Traditional Name: 1-(4-acetylpiperazino)-2-[3-(benzofuran-2-yl)benzyl]sulfinyl-ethanone Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=CC(=C2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=CC(=C2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H24N2O4S/c1-17(26)24-9-11-25(12-10-24)23(27)16-30(28)15-18-5-4-7-19(13-18)22-14-20-6-2-3-8-21(20)29-22/h2-8,13-14H,9-12,15-16H2,1H3