Vitas-M small molecule compound
1-[2-nitro-4-(trifluoromethyl)phenyl]-4-{2-[(4-phenyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazine
Catalog ID
STK063786
SMILES [O-][N+](=O)c1cc(ccc1N1CCN(CC1)CCOc1nonc1c1ccccc1)C(F)(F)F
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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 C21H20F3N5O4 MW 463.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O4/c22-21(23,24)16-6-7-17(18(14-16)29(30)31)28-10-8-27(9-11-28)12-13-32-20-19(25-33-26-20)15-4-2-1-3-5-15/h1-7,14H,8-13H2InChIKey
RCPYVDUQMFJEDZ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1N1CCN(CC1)CCOc1nonc1c1ccccc1)C(F)(F)F
1(2NITRO4(TRIFLUOROMETHYL)PHENYL)4(2((4PHENYL125OXADIAZOL3YL)OXY)ETHYL)PIPERAZINE
3(2(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ETHOXY)4PHENYL125OXADIAZOLE
3(2(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)ETHOXY)4PHENYL125OXADIAZOLE
C1CN(CCN1CCOC2=NON=C2C3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
InChI=1SC21H20F3N5O4c2221(2324)166717(18(1416)29(30)31)2810827(91128)1213322019(25332620)154213515h1714H813H2
MFCD01907123
STK063786
ZINC000054959730
ZINC54959730
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