Vitas-M small molecule compound
1-{2-[(4-methoxy-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Catalog ID
STK069176
SMILES COc1nonc1OCCN1CCN(CC1)c1ccc(cc1[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 C16H18F3N5O5 MW 417.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18F3N5O5/c1-27-14-15(21-29-20-14)28-9-8-22-4-6-23(7-5-22)12-3-2-11(16(17,18)19)10-13(12)24(25)26/h2-3,10H,4-9H2,1H3InChIKey
PYXJQLAQBQQEME-UHFFFAOYSA-NSynonyms
1(2((4METHOXY125OXADIAZOL3YL)OXY)ETHYL)4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE
3METHOXY4(2(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ETHOXY)125OXADIAZOLE
COC1=NON=C1OCCN2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
COc1nonc1OCCN1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC16H18F3N5O5c1271415(21292014)2898224623(7522)123211(16(1718)19)1013(12)24(25)26h2310H49H21H3
MFCD01872901
STK069176
ZINC000055135417
ZINC55135417
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