Vitas-M small molecule compound
4-(2-nitro-5-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)morpholine
Catalog ID
STK027904
SMILES [O-][N+](=O)c1cc(ccc1N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)[N+](=O)[O-])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 C21H22F3N5O5 MW 481.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N5O5/c22-21(23,24)15-1-3-17(20(13-15)29(32)33)26-7-5-25(6-8-26)16-2-4-18(28(30)31)19(14-16)27-9-11-34-12-10-27/h1-4,13-14H,5-12H2InChIKey
BWOZICBKQSLGMC-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)(N+)(=O)(O))C(F)(F)F
4(2NITRO5(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PHENYL)MORPHOLINE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))N3CCOCC3)C4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
InChI=1SC21H22F3N5O5c2221(2324)151317(20(1315)29(32)33)267525(6826)162418(28(30)31)19(1416)2791134121027h141314H512H2
MFCD01446599
STK027904
ZINC000009071111
ZINC09071111
ZINC9071111
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