methyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H17BrFNO4S MolecularWeight: 478.331383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)COC2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)COC2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17BrFNO4S/c1-12-18(13-6-8-15(23)9-7-13)19(21(26)27-2)20(29-12)24-17(25)11-28-16-5-3-4-14(22)10-16/h3-10H,11H2,1-2H3,(H,24,25)