2-(3-bromanyl-4-methoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(3-bromanyl-4-methoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-bromo-4-methoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-(3-bromo-4-methoxyphenyl)-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-bromo-4-methoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-bromo-4-methoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid Formula: C13H12BrNO3S MolecularWeight: 342.20828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OC)Br)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OC)Br)C(=O)O

InChI

InChI=1S/C13H12BrNO3S/c1-3-9-11(13(16)17)19-12(15-9)7-4-5-10(18-2)8(14)6-7/h4-6H,3H2,1-2H3,(H,16,17)