ethyl 3-(phenylmethylsulfanyl)-2-[[2-(trifluoromethyloxy)phenyl]sulfonylamino]propanoate

Systemtic Name: ethyl 3-(phenylmethylsulfanyl)-2-[[2-(trifluoromethyloxy)phenyl]sulfonylamino]propanoate Openeye Name: ethyl 3-benzylsulfanyl-2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]propanoate CAS Name: 3-(phenylmethylthio)-2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-benzylsulfanyl-2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]propanoate Traditional Name: 3-(benzylthio)-2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]propionic acid ethyl ester Formula: C19H20F3NO5S2 MolecularWeight: 463.49101

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC=C2OC(F)(F)F

Isomeric SMILES

CCOC(=O)C(CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC=C2OC(F)(F)F

InChI

InChI=1S/C19H20F3NO5S2/c1-2-27-18(24)15(13-29-12-14-8-4-3-5-9-14)23-30(25,26)17-11-7-6-10-16(17)28-19(20,21)22/h3-11,15,23H,2,12-13H2,1H3