Vitas-M small molecule compound

5-[(5-fluoro-2-nitrophenoxy)methyl]-3-(thiophen-2-yl)-1,2,4-oxadiazole

Catalog ID
STK775562
SMILES Fc1ccc(c(c1)OCc1onc(n1)c1cccs1)[N+](=O)[O-]

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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 C13H8FN3O4S MW 321.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8FN3O4S/c14-8-3-4-9(17(18)19)10(6-8)20-7-12-15-13(16-21-12)11-2-1-5-22-11/h1-6H,7H2
InChIKey
XIJRKMRFFKNHEO-UHFFFAOYSA-N
Synonyms
696640-42-3
4FLUORO1NITRO2((3(2THIENYL)(124OXADIAZOL5YL))METHOXY)BENZENE
5((5FLUORANYL2NITROPHENOXY)METHYL)3THIOPHEN2YL124OXADIAZOLE
5((5FLUORO2NITROPHENOXY)METHYL)3(2THIENYL)124OXADIAZOLE
5((5fluoro2nitrophenoxy)methyl)3(thiophen2yl)124oxadiazole
5((5FLUORO2NITROPHENOXY)METHYL)3THIEN2YL124OXADIAZOLE
5((5FLUORO2NITROPHENOXY)METHYL)3THIOPHEN2YL124OXADIAZOLE
696640423
C1=CSC(=C1)C2=NOC(=N2)COC3=C(C=CC(=C3)F)(N+)(=O)(O)
Fc1ccc(c(c1)OCc1onc(n1)c1cccs1)(N+)(=O)(O)
InChI=1SC13H8FN3O4Sc148349(17(18)19)10(68)207121513(162112)112152211h16H7H2
MFCD05257530
ZINC000004686676
ZINC04686676
ZINC4686676

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Available files

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