1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-2-(2-pyridylthio)ethanone Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O5S2/c1-26-15-6-7-16(27-2)17(13-15)29(24,25)22-11-9-21(10-12-22)19(23)14-28-18-5-3-4-8-20-18/h3-8,13H,9-12,14H2,1-2H3