propan-2-yl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]-4-(methylthio)butyric acid isopropyl ester Formula: C15H19BrF3NO5S2 MolecularWeight: 494.34427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

InChI

InChI=1S/C15H19BrF3NO5S2/c1-9(2)24-14(21)11(6-7-26-3)20-27(22,23)13-5-4-10(16)8-12(13)25-15(17,18)19/h4-5,8-9,11,20H,6-7H2,1-3H3