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

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[(2-cyano-3-p-phenetyl-acryloyl)amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H23ClN2O4S MolecularWeight: 494.98982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C26H23ClN2O4S/c1-4-32-21-12-6-17(7-13-21)14-19(15-28)24(30)29-25-23(26(31)33-5-2)22(16(3)34-25)18-8-10-20(27)11-9-18/h6-14H,4-5H2,1-3H3,(H,29,30)