1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[4-(4-propylphenyl)sulfonylpiperazino]-2-(2-pyridylthio)ethanone Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H25N3O3S2/c1-2-5-17-7-9-18(10-8-17)28(25,26)23-14-12-22(13-15-23)20(24)16-27-19-6-3-4-11-21-19/h3-4,6-11H,2,5,12-16H2,1H3