methyl 4-(4-ethoxyphenyl)-5-methyl-2-[4-(3-methylphenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-5-methyl-2-[4-(3-methylphenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-5-methyl-2-[4-(3-methylphenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-5-methyl-2-[[4-(3-methylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-5-methyl-2-[4-(3-methylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[4-(3-methylphenoxy)butanoylamino]-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C26H29NO5S MolecularWeight: 467.57716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCCOC3=CC=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCCOC3=CC=CC(=C3)C)C

InChI

InChI=1S/C26H29NO5S/c1-5-31-20-13-11-19(12-14-20)23-18(3)33-25(24(23)26(29)30-4)27-22(28)10-7-15-32-21-9-6-8-17(2)16-21/h6,8-9,11-14,16H,5,7,10,15H2,1-4H3,(H,27,28)