ethyl 5-azanyl-4-cyano-3-[(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-fluoro-3-morpholinosulfonyl-benzoyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-fluoro-3-morpholin-4-ylsulfonylbenzoyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(4-fluoro-3-morpholinosulfonyl-benzoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H20FN3O7S2 MolecularWeight: 497.517103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H20FN3O7S2/c1-2-30-20(26)17-14(13(10-22)18(23)32-17)11-31-19(25)12-3-4-15(21)16(9-12)33(27,28)24-5-7-29-8-6-24/h3-4,9H,2,5-8,11,23H2,1H3