Vitas-M small molecule compound
2-[1-(3,5-dimethylphenoxy)ethyl]-5-nitro-1H-benzimidazole
Catalog ID
STK914223
SMILES Cc1cc(cc(c1)C)OC(c1nc2c([nH]1)ccc(c2)[N+](=O)[O-])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 C17H17N3O3 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O3/c1-10-6-11(2)8-14(7-10)23-12(3)17-18-15-5-4-13(20(21)22)9-16(15)19-17/h4-9,12H,1-3H3,(H,18,19)InChIKey
BIOQOPXSNRAIGW-UHFFFAOYSA-NSynonyms
1225157-02-71225157027
2(1(35dimethylphenoxy)ethyl)5nitro1Hbenzimidazole
2(1(35dimethylphenoxy)ethyl)6nitro1Hbenzimidazole
CC1=CC(=CC(=C1)OC(C)C2=NC3=C(N2)C=C(C=C3)(N+)(=O)(O))C
Cc1cc(cc(c1)C)OC(c1nc2c((nH)1)ccc(c2)(N+)(=O)(O))C
InChI=1SC17H17N3O3c110611(2)814(710)2312(3)1718155413(20(21)22)916(15)1917h4912H13H3(H1819)
MFCD18175482
ZINC000041146138
ZINC000041146140
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