Vitas-M small molecule compound

(2Z)-6-(4-benzylpiperidin-1-yl)-2-[(3-chlorophenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine

Catalog ID
STK568807
SMILES Clc1cccc(c1)/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 C22H23ClN6O2 MW 438.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN6O2/c23-17-7-4-8-18(14-17)25-22-26-20(24)19(29(30)31)21(27-22)28-11-9-16(10-12-28)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2,(H3,24,25,26,27)
InChIKey
WUYXHHYDCSZNBB-UHFFFAOYSA-N
Synonyms
714226-72-9
714226729
Clc1cccc(c1)N=c1nc(N)c(c((nH)1)N1CCC(CC1)Cc1ccccc1)(N+)(=O)(O)
MFCD05727966
ZINC000009357442

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Available files

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