Vitas-M small molecule compound
2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromo-2-fluorophenyl)acetamide
Catalog ID
STK590567
SMILES COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)Br
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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 C20H17BrFN7O2S MW 518.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrFN7O2S/c1-31-13-5-2-11(3-6-13)16-9-17(26-25-16)19-27-28-20(29(19)23)32-10-18(30)24-15-7-4-12(21)8-14(15)22/h2-9H,10,23H2,1H3,(H,24,30)(H,25,26)InChIKey
AFYIZQWLHCUKAN-UHFFFAOYSA-NSynonyms
879462-65-42((4AMINO5(3(4METHOXYPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(4BROMO2FLUOROPHENYL)ACETAMIDE
2((4amino5(3(4methoxyphenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(4bromo2fluorophenyl)acetamide
2((4amino5(5(4methoxyphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(4bromo2fluorophenyl)acetamide
2(4AMINO5(3(4METHOXYPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(4BROMO2FLUOROPHENYL)ACETAMIDE
879462654
COC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)NC4=C(C=C(C=C4)Br)F
COc1ccc(cc1)c1(nH)nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)Br
COc1ccc(cc1)c1n(nH)c(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)Br
InChI=1SC20H17BrFN7O2Sc131135211(3613)16917(262516)19272820(29(19)23)321018(30)24157412(21)814(15)22h29H1023H21H3(H2430)(H2526)
MFCD07209967
ZINC000097990122
ZINC97990122
Check stock
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Check stock on Vitas-MAvailable files
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