Vitas-M small molecule compound
4,4'-[(6-bromo-1,3-benzodioxol-5-yl)methanediyl]bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK281860
SMILES Brc1cc2OCOc2cc1C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C
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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 C16H15BrN4O4 MW 407.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O4/c1-6-12(15(22)20-18-6)14(13-7(2)19-21-16(13)23)8-3-10-11(4-9(8)17)25-5-24-10/h3-4,14H,5H2,1-2H3,(H2,18,20,22)(H2,19,21,23)InChIKey
VAQGYTNSZGEDEN-UHFFFAOYSA-NSynonyms
4((6BROMO(2HBENZO(D)13DIOXOLEN5YL))(5HYDROXY3METHYLPYRAZOL4YL)METHYL)3METHYLPYRAZOL5OL
4((6BROMO13BENZODIOXOL5YL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((6bromo13benzodioxol5yl)methanediyl)bis(3methyl1Hpyrazol5ol)
44((6BROMO13BENZODIOXOL5YL)METHYLENE)BIS(3METHYL1HPYRAZOL5OL)
Brc1cc2OCOc2cc1C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
CC1=C(C(=O)NN1)C(C2=CC3=C(C=C2Br)OCO3)C4=C(NNC4=O)C
InChI=1SC16H15BrN4O4c1612(15(22)20186)14(137(2)192116(13)23)831011(49(8)17)2552410h3414H5H212H3(H2182022)(H2192123)
MFCD03042754
ZINC000019597755
ZINC19597755
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