methyl 2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C23H21BrClNO5S MolecularWeight: 538.83854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)COC3=C(C=C(C=C3)Cl)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)COC3=C(C=C(C=C3)Cl)Br)C

InChI

InChI=1S/C23H21BrClNO5S/c1-4-30-16-8-5-14(6-9-16)20-13(2)32-22(21(20)23(28)29-3)26-19(27)12-31-18-10-7-15(25)11-17(18)24/h5-11H,4,12H2,1-3H3,(H,26,27)