Vitas-M small molecule compound
5-(4-benzylpiperazin-1-yl)-1,3-diethyl-4,6-dinitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL376881
SMILES CCn1c(=O)n(c2c1c([N+](=O)[O-])c(N1CCN(CC1)Cc1ccccc1)c(c2)[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 C22H26N6O5 MW 454.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O5/c1-3-25-17-14-18(27(30)31)19(21(28(32)33)20(17)26(4-2)22(25)29)24-12-10-23(11-13-24)15-16-8-6-5-7-9-16/h5-9,14H,3-4,10-13,15H2,1-2H3InChIKey
XQMUBRNKIBDKAF-UHFFFAOYSA-NSynonyms
13DIETHYL46DINITRO5(4BENZYLPIPERAZINYL)3HYDROBENZIMIDAZOL2ONE
5(4benzylpiperazin1yl)13diethyl46dinitro13dihydro2Hbenzimidazol2one
5(4benzylpiperazin1yl)13diethyl46dinitrobenzimidazol2one
CCn1c(=O)n(c2c1c((N+)(=O)(O))c(N1CCN(CC1)Cc1ccccc1)c(c2)(N+)(=O)(O))CC
CCN1C2=CC(=C(C(=C2N(C1=O)CC)(N+)(=O)(O))N3CCN(CC3)CC4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC22H26N6O5c1325171418(27(30)31)19(21(28(32)33)20(17)26(42)22(25)29)24121023(111324)15168657916h5914H34101315H212H3
MFCD06760546
ZINC000055158232
ZINC55158232
Check stock
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