1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]-2-(2-pyridylthio)ethanone Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C18H19N3O4S2/c1-27(24,25)15-8-3-2-7-14(15)18(23)21-12-6-11-20(21)17(22)13-26-16-9-4-5-10-19-16/h2-5,7-10H,6,11-13H2,1H3