1-[2-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone

Systemtic Name: 1-[2-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Openeye Name: 1-[2-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone CAS Name: 1-[2-[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]-1-pyrazolidinyl]-2-(4-methylsulfonylphenyl)ethanone IUPAC Name: 1-[2-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]pyrazolidin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Traditional Name: 1-[2-[2-[(3,4-dimethoxyphenyl)thio]acetyl]pyrazolidin-1-yl]-2-(4-mesylphenyl)ethanone Formula: C22H26N2O6S2 MolecularWeight: 478.58164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)N2CCCN2C(=O)CC3=CC=C(C=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)N2CCCN2C(=O)CC3=CC=C(C=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C22H26N2O6S2/c1-29-19-10-7-17(14-20(19)30-2)31-15-22(26)24-12-4-11-23(24)21(25)13-16-5-8-18(9-6-16)32(3,27)28/h5-10,14H,4,11-13,15H2,1-3H3