Vitas-M small molecule compound
3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[3-(trifluoromethyl)benzyl]-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK782694
SMILES O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1cccc(c1)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 C15H11F3N6O4 MW 396.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11F3N6O4/c16-15(17,18)10-3-1-2-9(4-10)5-19-13(25)14-21-12(22-28-14)8-23-7-11(6-20-23)24(26)27/h1-4,6-7H,5,8H2,(H,19,25)InChIKey
OTUAPSJZHNYAEE-UHFFFAOYSA-NSynonyms
3((4nitro1Hpyrazol1yl)methyl)N(3(trifluoromethyl)benzyl)124oxadiazole5carboxamide
3((4NITROPYRAZOL1YL)METHYL)N((3(TRIFLUOROMETHYL)PHENYL)METHYL)124OXADIAZOLE5CARBOXAMIDE
C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C2=NC(=NO2)CN3C=C(C=N3)(N+)(=O)(O)
InChI=1SC15H11F3N6O4c1615(1718)103129(410)51913(25)142112(222814)823711(62023)24(26)27h1467H58H2(H1925)
MFCD06616630
O=C(c1onc(n1)Cn1ncc(c1)(N+)(=O)(O))NCc1cccc(c1)C(F)(F)F
ZINC000004743292
ZINC04743292
ZINC4743292
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