ethyl 2-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]-4-(3,4-dimethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H26BrNO6S MolecularWeight: 548.44604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC(=C(C=C3)OC)OC)C(=O)OCC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC(=C(C=C3)OC)OC)C(=O)OCC)Br

InChI

InChI=1S/C25H26BrNO6S/c1-5-15-7-9-19(18(26)11-15)33-13-22(28)27-24-23(25(29)32-6-2)17(14-34-24)16-8-10-20(30-3)21(12-16)31-4/h7-12,14H,5-6,13H2,1-4H3,(H,27,28)