1-[2-(2-methylsulfanylethanoyl)pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone

Systemtic Name: 1-[2-(2-methylsulfanylethanoyl)pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Openeye Name: 1-[2-(2-methylsulfanylacetyl)pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone CAS Name: 2-(4-methylsulfonylphenyl)-1-[2-[2-(methylthio)-1-oxoethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 1-[2-(2-methylsulfanylacetyl)pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Traditional Name: 2-(4-mesylphenyl)-1-[2-[2-(methylthio)acetyl]pyrazolidin-1-yl]ethanone Formula: C15H20N2O4S2 MolecularWeight: 356.4603

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CSCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C15H20N2O4S2/c1-22-11-15(19)17-9-3-8-16(17)14(18)10-12-4-6-13(7-5-12)23(2,20)21/h4-7H,3,8-11H2,1-2H3