ethyl 2-[4-(2,5-dimethylphenoxy)butanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-(2,5-dimethylphenoxy)butanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[4-(2,5-dimethylphenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[4-(2,5-dimethylphenoxy)-1-oxobutyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[4-(2,5-dimethylphenoxy)butanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[4-(2,5-dimethylphenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO5S/c1-6-27-22(26)19-15(4)20(16(5)24)29-21(19)23-18(25)8-7-11-28-17-12-13(2)9-10-14(17)3/h9-10,12H,6-8,11H2,1-5H3,(H,23,25)