1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-[2-(phenylsulfonyl)ethylsulfanyl]ethanone

Systemtic Name: 1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-[2-(phenylsulfonyl)ethylsulfanyl]ethanone Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]ethanone CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(2-besylethylthio)-1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethanone Formula: C21H24N2O6S3 MolecularWeight: 496.62006

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CSCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CSCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O6S3/c1-31(26,27)19-11-6-5-10-18(19)21(25)23-13-7-12-22(23)20(24)16-30-14-15-32(28,29)17-8-3-2-4-9-17/h2-6,8-11H,7,12-16H2,1H3