diethyl 3-methyl-5-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[4-[4-(1,1-dimethylpropyl)phenoxy]butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[4-[4-(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[4-(4-tert-amylphenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C26H35NO6S MolecularWeight: 489.6242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35NO6S/c1-7-26(5,6)18-12-14-19(15-13-18)33-16-10-11-20(28)27-23-21(24(29)31-8-2)17(4)22(34-23)25(30)32-9-3/h12-15H,7-11,16H2,1-6H3,(H,27,28)