O4-ethyl O2-methyl 5-[2-(4-butan-2-ylphenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 5-[2-(4-butan-2-ylphenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 3-methyl-5-[[2-(4-sec-butylphenoxy)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-[[2-(4-butan-2-ylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-sec-butylphenoxy)acetyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OCC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OCC

InChI

InChI=1S/C22H27NO6S/c1-6-13(3)15-8-10-16(11-9-15)29-12-17(24)23-20-18(21(25)28-7-2)14(4)19(30-20)22(26)27-5/h8-11,13H,6-7,12H2,1-5H3,(H,23,24)