ethyl 4-cyano-5-[2-(3,5-dimethylphenoxy)ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[2-(3,5-dimethylphenoxy)ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[2-(3,5-dimethylphenoxy)acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[2-(3,5-dimethylphenoxy)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-(3,5-dimethylphenoxy)acetyl]amino]-3-methyl-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)NC(=O)COC2=CC(=CC(=C2)C)C)C#N)C

Isomeric SMILES

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

InChI

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