Vitas-M small molecule compound
[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](4-iodo-1H-pyrazol-3-yl)methanone
Catalog ID
STK303089
SMILES O=C(c1n[nH]cc1I)N1N=C(CC1(O)C(F)(F)F)C
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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 C9H8F3IN4O2 MW 388.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8F3IN4O2/c1-4-2-8(19,9(10,11)12)17(16-4)7(18)6-5(13)3-14-15-6/h3,19H,2H2,1H3,(H,14,15)InChIKey
QYOZXTYGZPLIST-UHFFFAOYSA-NSynonyms
1005665-44-0(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)(4iodo1Hpyrazol3yl)methanone
(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)(4IODO1HPYRAZOL5YL)METHANONE
1005665440
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=C(C=NN2)I
InChI=1SC9H8F3IN4O2c1428(199(1011)12)17(164)7(18)65(13)314156h319H2H21H3(H1415)
MFCD04049332
O=C(c1n(nH)cc1I)N1N=C(CC1(O)C(F)(F)F)C
ZINC000018162214
ZINC000032488235
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