3-bromo-5-((4,5-dimethyl-4H-1,2,4-triazol-3-yl)thio)benzoic acid
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Basic information
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Exact Mass | 326.96771 |
Smiles | O=C(O)C1=CC(SC2=NN=C(C)N2C)=CC(Br)=C1 |
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Canonical Smiles | CC1=NN=C(SC2C=C(C=C(Br)C=2)C(O)=O)N1C |
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Inchi | InChI=1S/C11H10BrN3O2S/c1-6-13-14-11(15(6)2)18-9-4-7(10(16)17)3-8(12)5-9/h3-5H,1-2H3,(H,16,17) |
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InchiKey | OJMYANRBLVKSED-UHFFFAOYSA-N |
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Security information
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