Vitas-M small molecule compound
1,3-diethyl-5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK804202
SMILES CCn1c(=O)n(c2c1cc(/C=C/c1onc(c1[N+](=O)[O-])C)cc2)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 C17H18N4O4 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O4/c1-4-19-13-8-6-12(10-14(13)20(5-2)17(19)22)7-9-15-16(21(23)24)11(3)18-25-15/h6-10H,4-5H2,1-3H3/b9-7+InChIKey
XECRPNUZOXUDJO-VQHVLOKHSA-NSynonyms
879041-00-6(E)13diethyl5(2(3methyl4nitroisoxazol5yl)vinyl)1Hbenzo(d)imidazol2(3H)one
13diethyl5((E)2(3methyl4nitro12oxazol5yl)ethenyl)13dihydro2Hbenzimidazol2one
13DIETHYL5((E)2(3METHYL4NITRO12OXAZOL5YL)ETHENYL)BENZIMIDAZOL2ONE
879041006
CCn1c(=O)n(c2c1cc(C=Cc1onc(c1(N+)(=O)(O))C)cc2)CC
CCN1C2=C(C=C(C=C2)C=CC3=C(C(=NO3)C)(N+)(=O)(O))N(C1=O)CC
InChI=1SC17H18N4O4c1419138612(1014(13)20(52)17(19)22)791516(21(23)24)11(3)182515h610H45H213H3b97+
MFCD07402289
ZINC000004985796
ZINC04985796
ZINC4985796
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