Vitas-M small molecule compound
4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazine-1-carboxamide
Catalog ID
STK736059
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-])NC12CC3CC(C2)CC(C1)C3
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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 C26H34N6O3 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N6O3/c1-17-9-18(2)31(28-17)24-13-22(3-4-23(24)32(34)35)29-5-7-30(8-6-29)25(33)27-26-14-19-10-20(15-26)12-21(11-19)16-26/h3-4,9,13,19-21H,5-8,10-12,14-16H2,1-2H3,(H,27,33)InChIKey
NJWSLVNHDQJJHE-UHFFFAOYSA-NSynonyms
4(3(35dimethyl1Hpyrazol1yl)4nitrophenyl)N(tricyclo(3311~37~)dec1yl)piperazine1carboxamide
CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5)(N+)(=O)(O))C
InChI=1SC26H34N6O3c117918(2)31(2817)241322(3423(24)32(34)35)295730(8629)25(33)272614191020(1526)1221(1119)1626h349131921H5810121416H212H3(H2733)
MFCD05860603
N(1ADAMANTYL)4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZINE1CARBOXAMIDE
NADAMANTANYL(4(3(35DIMETHYLPYRAZOLYL)4NITROPHENYL)PIPERAZINYL)CARBOXAMIDE
O=C(N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O))NC12CC3CC(C2)CC(C1)C3
ZINC000012446078
ZINC12446078
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