ethyl 2-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-[4-(3-bromophenyl)-2-thiazolyl]-2-cyanoethenyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H18BrN3O3S2 MolecularWeight: 516.43062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H18BrN3O3S2/c1-4-29-22(28)18-12(2)19(13(3)27)31-21(18)25-10-15(9-24)20-26-17(11-30-20)14-6-5-7-16(23)8-14/h5-8,10-11,25H,4H2,1-3H3