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

Systemtic Name: N-(5-fluoranyl-2-methyl-phenyl)-2-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(5-fluoro-2-methyl-phenyl)-2-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(5-fluoro-2-methylphenyl)-2-[[2-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-(5-fluoro-2-methylphenyl)-2-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(5-fluoro-2-methyl-phenyl)-2-[[2-keto-2-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethyl]thio]acetamide Formula: C22H24FN3O5S2 MolecularWeight: 493.571463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C22H24FN3O5S2/c1-15-8-9-16(23)12-18(15)24-20(27)13-32-14-21(28)25-10-5-11-26(25)22(29)17-6-3-4-7-19(17)33(2,30)31/h3-4,6-9,12H,5,10-11,13-14H2,1-2H3,(H,24,27)