Vitas-M small molecule compound

(2Z)-6-(4-benzylpiperidin-1-yl)-2-[(4-methylphenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine

Catalog ID
STL053657
SMILES Cc1ccc(cc1)/N=c/1\nc(N)c(c([nH]1)N1CCC(CC1)Cc1ccccc1)[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 C23H26N6O2 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O2/c1-16-7-9-19(10-8-16)25-23-26-21(24)20(29(30)31)22(27-23)28-13-11-18(12-14-28)15-17-5-3-2-4-6-17/h2-10,18H,11-15H2,1H3,(H3,24,25,26,27)
InChIKey
NKDLZDARWBUMQM-UHFFFAOYSA-N
Synonyms
714941-06-7
714941067
Cc1ccc(cc1)N=c1nc(N)c(c((nH)1)N1CCC(CC1)Cc1ccccc1)(N+)(=O)(O)
MFCD05736651
ZINC000009328179

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.