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

Systemtic Name: diethyl 5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(2,4-ditert-amylphenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C31H45NO6S MolecularWeight: 559.7571

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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)C(C)(C)CC

Isomeric SMILES

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

InChI

InChI=1S/C31H45NO6S/c1-10-30(6,7)21-16-17-23(22(19-21)31(8,9)11-2)38-18-14-15-24(33)32-27-25(28(34)36-12-3)20(5)26(39-27)29(35)37-13-4/h16-17,19H,10-15,18H2,1-9H3,(H,32,33)