Vitas-M small molecule compound
methyl 2-(morpholin-4-yl)-6-(3-nitrophenyl)-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
Catalog ID
STK786838
SMILES COC(=O)C1(N=C(OC(=N1)c1cccc(c1)[N+](=O)[O-])N1CCOCC1)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 C16H15F3N4O6 MW 416.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3N4O6/c1-27-13(24)15(16(17,18)19)20-12(10-3-2-4-11(9-10)23(25)26)29-14(21-15)22-5-7-28-8-6-22/h2-4,9H,5-8H2,1H3InChIKey
HWOFDGAQJHUZNM-UHFFFAOYSA-NSynonyms
714240-62-7714240627
COC(=O)C1(N=C(OC(=N1)c1cccc(c1)(N+)(=O)(O))N1CCOCC1)C(F)(F)F
COC(=O)C1(N=C(OC(=N1)N2CCOCC2)C3=CC(=CC=C3)(N+)(=O)(O))C(F)(F)F
InChI=1SC16H15F3N4O6c12713(24)15(16(1718)19)2012(1032411(910)23(25)26)2914(2115)2257288622h249H58H21H3
methyl2(morpholin4yl)6(3nitrophenyl)4(trifluoromethyl)4H135oxadiazine4carboxylate
METHYL2MORPHOLIN4YL6(3NITROPHENYL)4(TRIFLUOROMETHYL)135OXADIAZINE4CARBOXYLATE
methyl2morpholino6(3nitrophenyl)4(trifluoromethyl)4H135oxadiazine4carboxylate
MFCD04163988
ZINC000001870512
ZINC000001870513
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