Vitas-M small molecule compound
1,3-dibenzyl-5-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL364552
SMILES O=c1n(Cc2ccccc2)c2c(n1Cc1ccccc1)cc(cc2)[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 C21H17N3O3 MW 359.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3/c25-21-22(14-16-7-3-1-4-8-16)19-12-11-18(24(26)27)13-20(19)23(21)15-17-9-5-2-6-10-17/h1-13H,14-15H2InChIKey
QIKMPZOPNHNPLO-UHFFFAOYSA-NSynonyms
55327-66-713dibenzyl5nitro13dihydro2Hbenzimidazol2one
13DIBENZYL5NITRO13DIHYDRO2HBENZO(D)IMIDAZOL2ONE
13DIBENZYL5NITRO13DIHYDROBENZOIMIDAZOL2ONE
13DIBENZYL5NITRO23DIHYDRO1H13BENZODIAZOL2ONE
13DIBENZYL5NITROBENZIMIDAZOL2ONE
55327667
C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)(N+)(=O)(O))N(C2=O)CC4=CC=CC=C4
InChI=1SC21H17N3O3c252122(14167314816)19121118(24(26)27)1320(19)23(21)151795261017h113H1415H2
MFCD00697907
O=c1n(Cc2ccccc2)c2c(n1Cc1ccccc1)cc(cc2)(N+)(=O)(O)
ZINC000000865565
ZINC00865565
ZINC865565
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