ethyl 2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[2-(4-chloro-3,5-dimethyl-phenoxy)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[2-(4-chloro-3,5-dimethylphenoxy)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[2-(4-chloro-3,5-dimethyl-phenoxy)propanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H24ClNO5S MolecularWeight: 437.93696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C(C)OC2=CC(=C(C(=C2)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C(C)OC2=CC(=C(C(=C2)C)Cl)C

InChI

InChI=1S/C21H24ClNO5S/c1-7-27-21(26)16-12(4)18(13(5)24)29-20(16)23-19(25)14(6)28-15-8-10(2)17(22)11(3)9-15/h8-9,14H,7H2,1-6H3,(H,23,25)