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

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[[(E)-2-cyano-3-(5-methoxy-2-oxidanyl-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[(E)-2-cyano-3-(2-hydroxy-5-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[(E)-2-cyano-3-(2-hydroxy-5-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[(E)-2-cyano-3-(2-hydroxy-5-methoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[(E)-2-cyano-3-(2-hydroxy-5-methoxy-phenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H19ClN2O5S MolecularWeight: 482.93606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19ClN2O5S/c1-3-32-24(30)21-19(14-4-6-17(25)7-5-14)13-33-23(21)27-22(29)16(12-26)10-15-11-18(31-2)8-9-20(15)28/h4-11,13,28H,3H2,1-2H3,(H,27,29)/b16-10+