Vitas-M small molecule compound
2-({4-ethyl-5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[(E)-{4-methoxy-3-[(3-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene]acetohydrazide
Catalog ID
STK305151
SMILES COc1ccc(cc1Cn1ccc(n1)[N+](=O)[O-])/C=N/NC(=O)CSc1nnc(n1CC)c1cc(nn1C)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H23F3N10O4S MW 592.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23F3N10O4S/c1-4-35-21(16-10-18(23(24,25)26)31-33(16)2)29-30-22(35)41-13-20(37)28-27-11-14-5-6-17(40-3)15(9-14)12-34-8-7-19(32-34)36(38)39/h5-11H,4,12-13H2,1-3H3,(H,28,37)/b27-11+InChIKey
IACVSJUELOOSMR-LUOAPIJWSA-NSynonyms
1005634-06-91005634069
2((4ethyl5(1methyl3(trifluoromethyl)1Hpyrazol5yl)4H124triazol3yl)sulfanyl)N((E)(4methoxy3((3nitro1Hpyrazol1yl)methyl)phenyl)methylidene)acetohydrazide
2((4ethyl5(2methyl5(trifluoromethyl)pyrazol3yl)124triazol3yl)sulfanyl)N((E)(4methoxy3((3nitropyrazol1yl)methyl)phenyl)methylideneamino)acetamide
CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=C(C=C2)OC)CN3C=CC(=N3)(N+)(=O)(O))C4=CC(=NN4C)C(F)(F)F
COc1ccc(cc1Cn1ccc(n1)(N+)(=O)(O))C=NNC(=O)CSc1nnc(n1CC)c1cc(nn1C)C(F)(F)F
InChI=1SC23H23F3N10O4Sc143521(161018(23(2425)26)3133(16)2)293022(35)411320(37)282711145617(403)15(914)12348719(3234)36(38)39h511H41213H213H3(H2837)b2711+
MFCD04049267
ZINC000102000220
ZINC102000216
Check stock
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Check stock on Vitas-MAvailable files
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