ethyl 5-ethanoyl-2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[3-(4-ethoxy-3-methoxyphenyl)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)OC

InChI

InChI=1S/C22H27NO6S/c1-6-28-16-10-8-15(12-17(16)27-5)9-11-18(25)23-21-19(22(26)29-7-2)13(3)20(30-21)14(4)24/h8,10,12H,6-7,9,11H2,1-5H3,(H,23,25)