N-(5-chloranyl-2-methoxy-phenyl)-2-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[2-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[2-keto-2-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethyl]thio]acetamide Formula: C22H24ClN3O6S2 MolecularWeight: 526.02546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C22H24ClN3O6S2/c1-32-18-9-8-15(23)12-17(18)24-20(27)13-33-14-21(28)25-10-5-11-26(25)22(29)16-6-3-4-7-19(16)34(2,30)31/h3-4,6-9,12H,5,10-11,13-14H2,1-2H3,(H,24,27)