Vitas-M small molecule compound

3-methyl-4-nitro-5-[(Z)-2-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}ethenyl]-1,2-oxazole

Catalog ID
STK728550
SMILES [O-][N+](=O)c1c(/C=C\c2ccc(o2)c2cccc(c2)C(F)(F)F)onc1C

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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 C17H11F3N2O4 MW 364.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11F3N2O4/c1-10-16(22(23)24)15(26-21-10)8-6-13-5-7-14(25-13)11-3-2-4-12(9-11)17(18,19)20/h2-9H,1H3/b8-6-
InChIKey
URWAGURGANUYRQ-VURMDHGXSA-N
Synonyms

(O)(N+)(=O)c1c(C=Cc2ccc(o2)c2cccc(c2)C(F)(F)F)onc1C
3methyl4nitro5((Z)2(5(3(trifluoromethyl)phenyl)furan2yl)ethenyl)12oxazole
CC1=NOC(=C1(N+)(=O)(O))C=CC2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F
InChI=1SC17H11F3N2O4c11016(22(23)24)15(262110)86135714(2513)1132412(911)17(1819)20h29H1H3b86
MFCD06632026
ZINC000004820957
ZINC04820957
ZINC4820957

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.