(4-bromanyl-2-fluoranyl-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-acetamido-4,5-dimethyl-3-thiophenecarboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-acetamido-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-acetamido-4,5-dimethyl-thiophene-3-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H15BrFNO3S MolecularWeight: 400.262603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=C(C=C(C=C2)Br)F)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=C(C=C(C=C2)Br)F)NC(=O)C)C

InChI

InChI=1S/C16H15BrFNO3S/c1-8-9(2)23-15(19-10(3)20)14(8)16(21)22-7-11-4-5-12(17)6-13(11)18/h4-6H,7H2,1-3H3,(H,19,20)