Vitas-M small molecule compound
N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STL402858
SMILES O=C(c1ccc2c(c1)OCCO2)NCCn1nc(cc1C)[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 C15H16N4O5 MW 332.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O5/c1-10-8-14(19(21)22)17-18(10)5-4-16-15(20)11-2-3-12-13(9-11)24-7-6-23-12/h2-3,8-9H,4-7H2,1H3,(H,16,20)InChIKey
IDAZZOLZCSWJLY-UHFFFAOYSA-NSynonyms
1005566-18-61005566186
2H3HBENZO(E)14DIOXAN6YLN(2(5METHYL3NITROPYRAZOLYL)ETHYL)CARBOXAMIDE
CC1=CC(=NN1CCNC(=O)C2=CC3=C(C=C2)OCCO3)(N+)(=O)(O)
InChI=1SC15H16N4O5c110814(19(21)22)1718(10)541615(20)11231213(911)24762312h2389H47H21H3(H1620)
MFCD04131220
N(2(5methyl3nitro1Hpyrazol1yl)ethyl)23dihydro14benzodioxine6carboxamide
N(2(5METHYL3NITROPYRAZOL1YL)ETHYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
O=C(c1ccc2c(c1)OCCO2)NCCn1nc(cc1C)(N+)(=O)(O)
ZINC000002794413
ZINC02794413
ZINC2794413
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