Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-yl}methanone
Catalog ID
STK302351
SMILES Cc1ccc(c(c1)[N+](=O)[O-])OCc1ccc(o1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F
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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 C18H15F4N3O6 MW 445.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F4N3O6/c1-9-2-4-13(12(6-9)25(28)29)30-8-10-3-5-14(31-10)16(26)24-18(27,17(21)22)7-11(23-24)15(19)20/h2-6,15,17,27H,7-8H2,1H3InChIKey
ZZZXJIMGMZNNAV-UHFFFAOYSA-NSynonyms
512823-26-6(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(5((4methyl2nitrophenoxy)methyl)furan2yl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(5((4METHYL2NITROPHENOXY)METHYL)FURAN2YL)METHANONE
35BIS(DIFLUOROMETHYL)1(5((2NITRO4METHYLPHENOXY)METHYL)2FUROYL)45DIHYDRO1HPYRAZOL5OL
512823266
CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)N3C(CC(=N3)C(F)F)(C(F)F)O)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))OCc1ccc(o1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F
InChI=1SC18H15F4N3O6c192413(12(69)25(28)29)308103514(3110)16(26)2418(2717(21)22)711(2324)15(19)20h26151727H78H21H3
MFCD03468360
ZINC000000653576
ZINC000000653579
Check stock
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Check stock on Vitas-MAvailable files
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