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

Systemtic Name: methyl 5-ethanoyl-2-[2-(4-fluoranylphenoxy)propanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-acetyl-2-[2-(4-fluorophenoxy)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-(4-fluorophenoxy)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-2-[2-(4-fluorophenoxy)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[2-(4-fluorophenoxy)propanoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H18FNO5S MolecularWeight: 379.402623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C(C)OC2=CC=C(C=C2)F)C(=O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C(C)OC2=CC=C(C=C2)F)C(=O)C

InChI

InChI=1S/C18H18FNO5S/c1-9-14(18(23)24-4)17(26-15(9)10(2)21)20-16(22)11(3)25-13-7-5-12(19)6-8-13/h5-8,11H,1-4H3,(H,20,22)