ethyl 4-cyano-3-methyl-5-[2-(2-prop-2-enylphenoxy)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[2-(2-prop-2-enylphenoxy)ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(2-allylphenoxy)acetyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[1-oxo-2-(2-prop-2-enylphenoxy)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[[2-(2-prop-2-enylphenoxy)acetyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[2-(2-allylphenoxy)acetyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC2=CC=CC=C2CC=C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC2=CC=CC=C2CC=C)C#N)C

InChI

InChI=1S/C20H20N2O4S/c1-4-8-14-9-6-7-10-16(14)26-12-17(23)22-19-15(11-21)13(3)18(27-19)20(24)25-5-2/h4,6-7,9-10H,1,5,8,12H2,2-3H3,(H,22,23)