ethyl 5-azanyl-4-cyano-3-[[2-(4-fluoranylphenoxy)-2-methyl-propanoyl]oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[2-(4-fluoranylphenoxy)-2-methyl-propanoyl]oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(4-fluorophenoxy)-2-methyl-propanoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[2-(4-fluorophenoxy)-2-methyl-1-oxopropoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(4-fluorophenoxy)-2-methylpropanoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(4-fluorophenoxy)-2-methyl-propanoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H19FN2O5S MolecularWeight: 406.427963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C(C)(C)OC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C(C)(C)OC2=CC=C(C=C2)F

InChI

InChI=1S/C19H19FN2O5S/c1-4-25-17(23)15-14(13(9-21)16(22)28-15)10-26-18(24)19(2,3)27-12-7-5-11(20)6-8-12/h5-8H,4,10,22H2,1-3H3