Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STL397824
SMILES O=C(c1n(C)ncc1[N+](=O)[O-])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 C13H12N4O5 MW 304.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O5/c1-16-12(9(7-14-16)17(19)20)13(18)15-8-2-3-10-11(6-8)22-5-4-21-10/h2-3,6-7H,4-5H2,1H3,(H,15,18)InChIKey
MJUBZHYUTYYYKQ-UHFFFAOYSA-NSynonyms
514818-14-5514818145
CN1C(=C(C=N1)(N+)(=O)(O))C(=O)NC2=CC3=C(C=C2)OCCO3
InChI=1SC13H12N4O5c11612(9(71416)17(19)20)13(18)158231011(68)22542110h2367H45H21H3(H1518)
MFCD03071399
N(23DIHYDRO14BENZODIOXIN6YL)1METHYL4NITRO1HPYRAZOLE5CARBOXAMIDE
N(23DIHYDRO14BENZODIOXIN6YL)2METHYL4NITROPYRAZOLE3CARBOXAMIDE
N(23DIHYDRO14BENZODIOXIN6YL)4NITRO1METHYL1HPYRAZOLE5CARBOXAMIDE
O=C(c1n(C)ncc1(N+)(=O)(O))Nc1ccc2c(c1)OCCO2
ZINC000000356006
ZINC00356006
ZINC356006
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