ethyl 5-azanyl-4-cyano-3-[3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoyloxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[1-oxo-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoyloxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoyloxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H18F3N3O6S2 MolecularWeight: 505.48793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O6S2/c1-2-30-18(27)16-14(13(9-23)17(24)32-16)10-31-15(26)6-7-25-33(28,29)12-5-3-4-11(8-12)19(20,21)22/h3-5,8,25H,2,6-7,10,24H2,1H3