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

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-(4-methoxyphenyl)acryloyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H21ClN2O4S MolecularWeight: 480.96324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C25H21ClN2O4S/c1-4-32-25(30)22-21(17-7-9-19(26)10-8-17)15(2)33-24(22)28-23(29)18(14-27)13-16-5-11-20(31-3)12-6-16/h5-13H,4H2,1-3H3,(H,28,29)