ethyl 5-azanyl-3-[[2-chloranyl-4,5-bis(fluoranyl)phenyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[[2-chloranyl-4,5-bis(fluoranyl)phenyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[(2-chloro-4,5-difluoro-benzoyl)oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[(2-chloro-4,5-difluorophenyl)-oxomethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(2-chloro-4,5-difluorobenzoyl)oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[(2-chloro-4,5-difluoro-benzoyl)oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C16H11ClF2N2O4S MolecularWeight: 400.784346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(C=C2Cl)F)F

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(C=C2Cl)F)F

InChI

InChI=1S/C16H11ClF2N2O4S/c1-2-24-16(23)13-9(8(5-20)14(21)26-13)6-25-15(22)7-3-11(18)12(19)4-10(7)17/h3-4H,2,6,21H2,1H3