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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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