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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-ethoxycarbonylphenoxy)methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-ethoxycarbonylphenoxy)methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(4-ethoxycarbonylphenoxy)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-ethoxycarbonylphenoxy)methyl]thiophene-2-carboxylate Traditional Name: 5-amino-3-[(4-carbethoxyphenoxy)methyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C18H18N2O5S/c1-3-23-17(21)11-5-7-12(8-6-11)25-10-14-13(9-19)16(20)26-15(14)18(22)24-4-2/h5-8H,3-4,10,20H2,1-2H3