(S)-6-(5-(1-(3-chloro-5-(methylsulfonyl)benzamido)ethyl)-3-cyclopropyl-1H-1,2,4-triazol-1-yl)pyrimidine-4-carboxamide
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Basic information
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Exact Mass | 489.09860 |
Smiles | O=C(C1=NC=NC(N2N=C(C3CC3)N=C2[C@@H](NC(C2=CC(S(=O)(C)=O)=CC(Cl)=C2)=O)C)=C1)N |
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Canonical Smiles | C[C@H](NC(=O)C1C=C(Cl)C=C(C=1)S(C)(=O)=O)C1=NC(=NN1C1=CC(=NC=N1)C(N)=O)C1CC1 |
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Inchi | InChI=1S/C20H20ClN7O4S/c1-10(25-20(30)12-5-13(21)7-14(6-12)33(2,31)32)19-26-18(11-3-4-11)27-28(19)16-8-15(17(22)29)23-9-24-16/h5-11H,3-4H2,1-2H3,(H2,22,29)(H,25,30)/t10-/m0/s1 |
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InchiKey | XMUWITVLNPFLOU-JTQLQIEISA-N |
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