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

Systemtic Name: ethyl 2-[[3-(3-bromanyl-4-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(3-bromo-4-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-(4-chlorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(3-bromo-4-methoxyphenyl)-2-cyanoprop-2-enoyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(3-bromo-4-methoxy-phenyl)-2-cyano-acryloyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H18BrClN2O4S MolecularWeight: 545.83272

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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=CC(=C(C=C3)OC)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H18BrClN2O4S/c1-3-32-24(30)21-18(15-5-7-17(26)8-6-15)13-33-23(21)28-22(29)16(12-27)10-14-4-9-20(31-2)19(25)11-14/h4-11,13H,3H2,1-2H3,(H,28,29)