diethyl 5-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H28BrNO6S MolecularWeight: 526.44052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C23H28BrNO6S/c1-7-29-21(27)18-13(3)19(22(28)30-8-2)32-20(18)25-17(26)12-31-16-10-9-14(24)11-15(16)23(4,5)6/h9-11H,7-8,12H2,1-6H3,(H,25,26)