Vitas-M small molecule compound
5,5'-piperazine-1,4-diylbis[4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazole]
Catalog ID
STK528990
SMILES [O-][N+](=O)c1c(cc(c2c1non2)N1CCCCC1)N1CCN(CC1)c1cc(N2CCCCC2)c2c(c1[N+](=O)[O-])non2
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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 C26H30N10O6 MW 578.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N10O6/c37-35(38)25-19(15-17(21-23(25)29-41-27-21)31-7-3-1-4-8-31)33-11-13-34(14-12-33)20-16-18(32-9-5-2-6-10-32)22-24(30-42-28-22)26(20)36(39)40/h15-16H,1-14H2InChIKey
OBSBIODYVHKRAL-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1c(cc(c2c1non2)N1CCCCC1)N1CCN(CC1)c1cc(N2CCCCC2)c2c(c1(N+)(=O)(O))non2
14bis(4nitro7(piperidin1yl)benzo(c)(125)oxadiazol5yl)piperazine
4NITRO5(4(4NITRO7PIPERIDIN1YL213BENZOXADIAZOL5YL)PIPERAZIN1YL)7PIPERIDIN1YL213BENZOXADIAZOLE
55piperazine14diylbis(4nitro7(piperidin1yl)213benzoxadiazole)
C1CCN(CC1)C2=CC(=C(C3=NON=C23)(N+)(=O)(O))N4CCN(CC4)C5=C(C6=NON=C6C(=C5)N7CCCCC7)(N+)(=O)(O)
InChI=1SC26H30N10O6c3735(38)2519(1517(2123(25)29412721)317314831)33111334(141233)201618(3295261032)2224(30422822)26(20)36(39)40h1516H114H2
MFCD01853619
ZINC000102607351
ZINC102607351
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