ethyl 2-[[4-butoxy-3,5-bis(chloranyl)phenyl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-butoxy-3,5-bis(chloranyl)phenyl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(4-butoxy-3,5-dichloro-benzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(4-butoxy-3,5-dichlorophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(4-butoxy-3,5-dichlorobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(4-butoxy-3,5-dichloro-benzoyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H23Cl2NO5S MolecularWeight: 472.38202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)Cl

InChI

InChI=1S/C21H23Cl2NO5S/c1-5-7-8-29-17-14(22)9-13(10-15(17)23)19(26)24-20-16(21(27)28-6-2)11(3)18(30-20)12(4)25/h9-10H,5-8H2,1-4H3,(H,24,26)