Vitas-M small molecule compound
3-[(3-nitro-1H-pyrazol-1-yl)methyl]-N-[3-(trifluoromethyl)benzyl]-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK782725
SMILES O=C(c1onc(n1)Cn1ccc(n1)[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(6-10)7-19-13(25)14-20-11(22-28-14)8-23-5-4-12(21-23)24(26)27/h1-6H,7-8H2,(H,19,25)InChIKey
SMHNEYAFMVYMAC-UHFFFAOYSA-NSynonyms
3((3nitro1Hpyrazol1yl)methyl)N(3(trifluoromethyl)benzyl)124oxadiazole5carboxamide
3((3NITROPYRAZOL1YL)METHYL)N((3(TRIFLUOROMETHYL)PHENYL)METHYL)124OXADIAZOLE5CARBOXAMIDE
C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C2=NC(=NO2)CN3C=CC(=N3)(N+)(=O)(O)
InChI=1SC15H11F3N6O4c1615(1718)103129(610)71913(25)142011(222814)8235412(2123)24(26)27h16H78H2(H1925)
MFCD06616664
O=C(c1onc(n1)Cn1ccc(n1)(N+)(=O)(O))NCc1cccc(c1)C(F)(F)F
ZINC000004743375
ZINC04743375
ZINC4743375
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