Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-amine
Catalog ID
STK783210
SMILES [O-][N+](=O)c1cn[nH]c1c1nnc([nH]1)Nc1ccc2c(c1)OCCO2
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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 C13H11N7O4 MW 329.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N7O4/c21-20(22)8-6-14-17-11(8)12-16-13(19-18-12)15-7-1-2-9-10(5-7)24-4-3-23-9/h1-2,5-6H,3-4H2,(H,14,17)(H2,15,16,18,19)InChIKey
BGPRUAJNCFJAPP-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cn(nH)c1c1nnc((nH)1)Nc1ccc2c(c1)OCCO2
C1COC2=C(O1)C=CC(=C2)NC3=NNC(=N3)C4=C(C=NN4)(N+)(=O)(O)
InChI=1SC13H11N7O4c2120(22)86141711(8)121613(191812)15712910(57)2443239h1256H34H2(H1417)(H215161819)
MFCD06617788
N(23DIHYDRO14BENZODIOXIN6YL)5(4NITRO1HPYRAZOL5YL)1H124TRIAZOL3AMINE
N(23dihydro14benzodioxin6yl)5(4nitro1Hpyrazol5yl)4H124triazol3amine
ZINC000012375170
ZINC12375170
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