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

Systemtic Name: diethyl 5-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[4-(4-chloro-3,5-dimethylphenoxy)-1-oxobutyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[4-(4-chloro-3,5-dimethylphenoxy)butanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H28ClNO6S MolecularWeight: 481.98952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCOC2=CC(=C(C(=C2)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCOC2=CC(=C(C(=C2)C)Cl)C

InChI

InChI=1S/C23H28ClNO6S/c1-6-29-22(27)18-15(5)20(23(28)30-7-2)32-21(18)25-17(26)9-8-10-31-16-11-13(3)19(24)14(4)12-16/h11-12H,6-10H2,1-5H3,(H,25,26)