Vitas-M small molecule compound
N-(2,5-difluorophenyl)-4-nitro-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazole-3-carboxamide
Catalog ID
STK316804
SMILES O=C(c1nn(cc1[N+](=O)[O-])C12CC3CC(C2)CC(C1)C3)Nc1cc(F)ccc1F
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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 C20H20F2N4O3 MW 402.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F2N4O3/c21-14-1-2-15(22)16(6-14)23-19(27)18-17(26(28)29)10-25(24-18)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,10-13H,3-5,7-9H2,(H,23,27)InChIKey
CSIBNBFNWVBZFC-UHFFFAOYSA-NSynonyms
515149-94-71(1ADAMANTYL)N(25DIFLUOROPHENYL)4NITRO1HPYRAZOLE3CARBOXAMIDE
1(1ADAMANTYL)N(25DIFLUOROPHENYL)4NITROPYRAZOLE3CARBOXAMIDE
515149947
C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=C(C=CC(=C5)F)F)(N+)(=O)(O)
InChI=1SC20H20F2N4O3c21141215(22)16(614)2319(27)1817(26(28)29)1025(2418)20711312(820)513(411)920h1261013H3579H2(H2327)
MFCD03758318
N(25difluorophenyl)4nitro1(tricyclo(3311~37~)dec1yl)1Hpyrazole3carboxamide
O=C(c1nn(cc1(N+)(=O)(O))C12CC3CC(C2)CC(C1)C3)Nc1cc(F)ccc1F
ZINC000004650842
ZINC04650842
ZINC4650842
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