Vitas-M small molecule compound
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-5-nitro-1H-benzimidazole
Catalog ID
STK914216
SMILES Cc1ccc(c(c1)OCc1nc2c([nH]1)ccc(c2)[N+](=O)[O-])C(C)C
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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 C18H19N3O3 MW 325.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O3/c1-11(2)14-6-4-12(3)8-17(14)24-10-18-19-15-7-5-13(21(22)23)9-16(15)20-18/h4-9,11H,10H2,1-3H3,(H,19,20)InChIKey
QBXITIUYTXMEMW-UHFFFAOYSA-NSynonyms
2((5methyl2(propan2yl)phenoxy)methyl)5nitro1Hbenzimidazole
2((5methyl2propan2ylphenoxy)methyl)6nitro1Hbenzimidazole
4METHYL1(METHYLETHYL)2((5NITROBENZIMIDAZOL2YL)METHOXY)BENZENE
CC1=CC(=C(C=C1)C(C)C)OCC2=NC3=C(N2)C=C(C=C3)(N+)(=O)(O)
Cc1ccc(c(c1)OCc1nc2c((nH)1)ccc(c2)(N+)(=O)(O))C(C)C
InChI=1SC18H19N3O3c111(2)146412(3)817(14)24101819157513(21(22)23)916(15)2018h4911H10H213H3(H1920)
MFCD12548147
ZINC000016902398
ZINC16902398
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