ethyl 5-azanyl-4-cyano-3-[(2,4,6-trimethylphenyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(2,4,6-trimethylphenyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(2,4,6-trimethylbenzoyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[oxo-(2,4,6-trimethylphenyl)methoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2,4,6-trimethylbenzoyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2,4,6-trimethylbenzoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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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=C(C=C2C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C19H20N2O4S/c1-5-24-19(23)16-14(13(8-20)17(21)26-16)9-25-18(22)15-11(3)6-10(2)7-12(15)4/h6-7H,5,9,21H2,1-4H3