2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone CAS Name: 1-[4-(4-acetylphenyl)-1-piperazinyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)ethanone IUPAC Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone Traditional Name: 1-[4-(4-acetylphenyl)piperazino]-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)ethanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

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