ethyl 2-[3-(3-chlorophenyl)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(3-chlorophenyl)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[3-(3-chlorophenyl)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[3-(3-chlorophenyl)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[3-(3-chlorophenyl)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[3-(3-chlorophenyl)propanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H20ClNO4S/c1-4-25-19(24)16-11(2)17(12(3)22)26-18(16)21-15(23)9-8-13-6-5-7-14(20)10-13/h5-7,10H,4,8-9H2,1-3H3,(H,21,23)