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

Systemtic Name: ethyl 5-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[3-(4-chlorophenyl)-2-cyano-acryloyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H14ClN3O3S MolecularWeight: 399.85076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N)C#N)C

InChI

InChI=1S/C19H14ClN3O3S/c1-3-26-19(25)16-11(2)15(10-22)18(27-16)23-17(24)13(9-21)8-12-4-6-14(20)7-5-12/h4-8H,3H2,1-2H3,(H,23,24)