Vitas-M small molecule compound
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]ethanone
Catalog ID
STK683181
SMILES O=C(N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)Cn1nc(c(c1C)Cl)[N+](=O)[O-]
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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 C20H28ClN5O3 MW 421.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28ClN5O3/c1-13-18(21)19(26(28)29)22-25(13)12-17(27)23-2-4-24(5-3-23)20-9-14-6-15(10-20)8-16(7-14)11-20/h14-16H,2-12H2,1H3InChIKey
PIDAKPFYXFZVOB-UHFFFAOYSA-NSynonyms
1(4(1ADAMANTYL)PIPERAZIN1YL)2(4CHLORO5METHYL3NITROPYRAZOL1YL)ETHANONE
1(4ADAMANTANYLPIPERAZINYL)2(4CHLORO5METHYL3NITROPYRAZOLYL)ETHAN1ONE
2(4chloro5methyl3nitro1Hpyrazol1yl)1(4(tricyclo(3311~37~)dec1yl)piperazin1yl)ethanone
CC1=C(C(=NN1CC(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)(N+)(=O)(O))Cl
InChI=1SC20H28ClN5O3c11318(21)19(26(28)29)2225(13)1217(27)232424(5323)20914615(1020)816(714)1120h1416H212H21H3
MFCD05256970
O=C(N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)Cn1nc(c(c1C)Cl)(N+)(=O)(O)
ZINC000004686111
ZINC4686111
Check stock
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