ethyl 3-azanyl-5-(4-bromanyl-2-fluoranyl-phenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-5-(4-bromanyl-2-fluoranyl-phenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-amino-5-(4-bromo-2-fluoro-phenyl)thiophene-2-carboxylate CAS Name: 3-amino-5-(4-bromo-2-fluorophenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-(4-bromo-2-fluorophenyl)thiophene-2-carboxylate Traditional Name: 3-amino-5-(4-bromo-2-fluoro-phenyl)thiophene-2-carboxylic acid ethyl ester Formula: C13H11BrFNO2S MolecularWeight: 344.199343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=C(C=C(C=C2)Br)F)N

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=C(C=C(C=C2)Br)F)N

InChI

InChI=1S/C13H11BrFNO2S/c1-2-18-13(17)12-10(16)6-11(19-12)8-4-3-7(14)5-9(8)15/h3-6H,2,16H2,1H3