ethyl 2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[3-(4-chlorophenyl)-2-cyano-acryloyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C20H17ClN2O4S/c1-4-27-20(26)16-11(2)17(12(3)24)28-19(16)23-18(25)14(10-22)9-13-5-7-15(21)8-6-13/h5-9H,4H2,1-3H3,(H,23,25)