(S)-3-chloro-N-(1-(1-(5-(2-cyanoacetamido)pyridin-2-yl)-1H-1,2,4-triazol-5-yl)ethyl)-5-(methylsulfonyl)benzamide
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Basic information
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Exact Mass | 487.08295 |
Smiles | O=C(N[C@H](C1=NC=NN1C1=NC=C(NC(CC#N)=O)C=C1)C)C1=CC(S(=O)(C)=O)=CC(Cl)=C1 |
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Canonical Smiles | C[C@H](NC(=O)C1C=C(Cl)C=C(C=1)S(C)(=O)=O)C1=NC=NN1C1C=CC(=CN=1)NC(=O)CC#N |
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Inchi | InChI=1S/C20H18ClN7O4S/c1-12(26-20(30)13-7-14(21)9-16(8-13)33(2,31)32)19-24-11-25-28(19)17-4-3-15(10-23-17)27-18(29)5-6-22/h3-4,7-12H,5H2,1-2H3,(H,26,30)(H,27,29)/t12-/m0/s1 |
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InchiKey | YNMGJPIMZVJRPO-LBPRGKRZSA-N |
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