ethyl 2-[[2-cyano-3-(5-methoxy-2-oxidanyl-phenyl)prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-cyano-3-(5-methoxy-2-oxidanyl-phenyl)prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-cyano-3-(2-hydroxy-5-methoxy-phenyl)prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-cyano-3-(2-hydroxy-5-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyano-3-(2-hydroxy-5-methoxyphenyl)prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-cyano-3-(2-hydroxy-5-methoxy-phenyl)acryloyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H22N2O6S MolecularWeight: 478.51698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O6S/c1-4-33-25(30)22-20(15-5-7-18(31-2)8-6-15)14-34-24(22)27-23(29)17(13-26)11-16-12-19(32-3)9-10-21(16)28/h5-12,14,28H,4H2,1-3H3,(H,27,29)