Vitas-M small molecule compound

6-(4-methylpiperazin-1-yl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4-diamine

Catalog ID
STK569739
SMILES C=CCNc1nc(N2CCN(CC2)C)c(c(n1)N)[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 C12H19N7O2 MW 293.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N7O2/c1-3-4-14-12-15-10(13)9(19(20)21)11(16-12)18-7-5-17(2)6-8-18/h3H,1,4-8H2,2H3,(H3,13,14,15,16)
InChIKey
PLQOTSADWFSWGI-UHFFFAOYSA-N
Synonyms
716340-52-2
(4AMINO6(4METHYLPIPERAZINYL)5NITROPYRIMIDIN2YL)PROP2ENYLAMINE
6(4METHYLPIPERAZIN1YL)5NITRO2NPROP2ENYLPYRIMIDINE24DIAMINE
6(4methylpiperazin1yl)5nitroN~2~(prop2en1yl)pyrimidine24diamine
6(4METHYLPIPERAZIN1YL)5NITRON2(PROP2EN1YL)PYRIMIDINE24DIAMINE
716340522
C=CCNc1nc(N2CCN(CC2)C)c(c(n1)N)(N+)(=O)(O)
CN1CCN(CC1)C2=C(C(=NC(=N2)NCC=C)N)(N+)(=O)(O)
InChI=1SC12H19N7O2c13414121510(13)9(19(20)21)11(1612)187517(2)6818h3H148H22H3(H313141516)
MFCD04176649
N2allyl6(4methylpiperazin1yl)5nitropyrimidine24diamine
ZINC000005216088
ZINC5216088

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Available files

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