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

Systemtic Name: methyl 2-[2-(2-bromanyl-4-methyl-phenoxy)ethanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-bromo-4-methylphenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H19BrFNO4S MolecularWeight: 492.357963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)F)C(=O)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)F)C(=O)OC)Br

InChI

InChI=1S/C22H19BrFNO4S/c1-12-4-9-17(16(23)10-12)29-11-18(26)25-21-20(22(27)28-3)19(13(2)30-21)14-5-7-15(24)8-6-14/h4-10H,11H2,1-3H3,(H,25,26)