Vitas-M small molecule compound
4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-3-nitro-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzamide
Catalog ID
STK157509
SMILES O=C(C(C)(C)C)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(=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 C26H36N4O4 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N4O4/c1-25(2,3)24(32)29-8-6-28(7-9-29)21-5-4-20(13-22(21)30(33)34)23(31)27-26-14-17-10-18(15-26)12-19(11-17)16-26/h4-5,13,17-19H,6-12,14-16H2,1-3H3,(H,27,31)InChIKey
YVUGKXOSISLWAH-UHFFFAOYSA-NSynonyms
524041-80-34(4(22dimethylpropanoyl)piperazin1yl)3nitroN(tricyclo(3311~37~)dec1yl)benzamide
524041803
CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)(N+)(=O)(O)
InChI=1SC26H36N4O4c125(23)24(32)298628(7929)215420(1322(21)30(33)34)23(31)272614171018(1526)1219(1117)1626h45131719H6121416H213H3(H2731)
MFCD03614927
N(1ADAMANTYL)4(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)3NITROBENZAMIDE
O=C(C(C)(C)C)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(=O)NC12CC3CC(C2)CC(C1)C3
ZINC000009540697
ZINC09540697
ZINC9540697
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