ethyl 5-azanyl-4-cyano-3-[(4-ethanoylphenoxy)methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-ethanoylphenoxy)methyl]thiophene-2-carboxylate Openeye Name: ethyl 3-[(4-acetylphenoxy)methyl]-5-amino-4-cyano-thiophene-2-carboxylate CAS Name: 3-[(4-acetylphenoxy)methyl]-5-amino-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-acetylphenoxy)methyl]-5-amino-4-cyanothiophene-2-carboxylate Traditional Name: 3-[(4-acetylphenoxy)methyl]-5-amino-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C17H16N2O4S/c1-3-22-17(21)15-14(13(8-18)16(19)24-15)9-23-12-6-4-11(5-7-12)10(2)20/h4-7H,3,9,19H2,1-2H3