ethyl 4,5-dimethyl-2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[4-(3-methyl-4-propan-2-ylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[4-(3-methyl-4-propan-2-ylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4S/c1-7-27-23(26)21-16(5)17(6)29-22(21)24-20(25)9-8-12-28-18-10-11-19(14(2)3)15(4)13-18/h10-11,13-14H,7-9,12H2,1-6H3,(H,24,25)