Vitas-M small molecule compound
N-[(5-bromo-1H-1,2,4-triazol-3-yl)methyl]-2-[1-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)cyclohexyl]acetamide
Catalog ID
STL579930
SMILES O=C(CC1(CCCCC1)c1oc(C)cc(=O)c1O)NCc1n[nH]c(n1)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 C17H21BrN4O4 MW 425.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21BrN4O4/c1-10-7-11(23)14(25)15(26-10)17(5-3-2-4-6-17)8-13(24)19-9-12-20-16(18)22-21-12/h7,25H,2-6,8-9H2,1H3,(H,19,24)(H,20,21,22)InChIKey
UBDWOJLRMOUGJD-UHFFFAOYSA-NSynonyms
InChI=1SC17H21BrN4O4c110711(23)14(25)15(2610)17(5324617)813(24)199122016(18)222112h725H2689H21H3(H1924)(H202122)
MFCD33398210
N((3bromo1H124triazol5yl)methyl)2(1(3hydroxy6methyl4oxo4Hpyran2yl)cyclohexyl)acetamide
N((5bromo1H124triazol3yl)methyl)2(1(3hydroxy6methyl4oxo4Hpyran2yl)cyclohexyl)acetamide
O=C(CC1(CCCCC1)c1oc(C)cc(=O)c1O)NCc1(nH)nc(n1)Br
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