Vitas-M small molecule compound
1,3-diethyl-5-methoxy-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK764726
SMILES COc1cc2n(CC)c(=O)n(c2cc1[N+](=O)[O-])CC
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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 C12H15N3O4 MW 265.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O4/c1-4-13-8-6-10(15(17)18)11(19-3)7-9(8)14(5-2)12(13)16/h6-7H,4-5H2,1-3H3InChIKey
SCGYISXIFOUPQT-UHFFFAOYSA-NSynonyms
13diethyl5methoxy6nitro13dihydro2Hbenzimidazol2one
13DIETHYL5METHOXY6NITRO13DIHYDROBENZOIMIDAZOL2ONE
13DIETHYL5METHOXY6NITRO3HYDROBENZIMIDAZOL2ONE
13DIETHYL5METHOXY6NITROBENZIMIDAZOL2ONE
CCN1C2=CC(=C(C=C2N(C1=O)CC)OC)(N+)(=O)(O)
COc1cc2n(CC)c(=O)n(c2cc1(N+)(=O)(O))CC
InChI=1SC12H15N3O4c14138610(15(17)18)11(193)79(8)14(52)12(13)16h67H45H213H3
MFCD02628159
ZINC000000088693
ZINC00088693
ZINC88693
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