Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-2-({4-ethyl-5-[(5-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK307863
SMILES CCn1c(SCC(=O)Nc2ccc(cc2F)Br)nnc1Cn1nccc1C
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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 C17H18BrFN6OS MW 453.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18BrFN6OS/c1-3-24-15(9-25-11(2)6-7-20-25)22-23-17(24)27-10-16(26)21-14-5-4-12(18)8-13(14)19/h4-8H,3,9-10H2,1-2H3,(H,21,26)InChIKey
LMSGLJJBKVFATA-UHFFFAOYSA-NSynonyms
1005638-67-41005638674
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)F)CN3C(=CC=N3)C
InChI=1SC17H18BrFN6OSc132415(92511(2)672025)222317(24)271016(26)21145412(18)813(14)19h48H3910H212H3(H2126)
MFCD05666949
N(4bromo2fluorophenyl)2((4ethyl5((5methyl1Hpyrazol1yl)methyl)4H124triazol3yl)sulfanyl)acetamide
N(4bromo2fluorophenyl)2((4ethyl5((5methylpyrazol1yl)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000002794554
ZINC02794554
ZINC2794554
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