ethyl 5-azanyl-3-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[[2-(2-chloro-6-fluoro-phenyl)acetyl]oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[2-(2-chloro-6-fluorophenyl)-1-oxoethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[[2-(2-chloro-6-fluorophenyl)acetyl]oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[[2-(2-chloro-6-fluoro-phenyl)acetyl]oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C17H14ClFN2O4S MolecularWeight: 396.820463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C17H14ClFN2O4S/c1-2-24-17(23)15-11(10(7-20)16(21)26-15)8-25-14(22)6-9-12(18)4-3-5-13(9)19/h3-5H,2,6,8,21H2,1H3