Vitas-M small molecule compound

6-(4-benzylpiperidin-1-yl)-N~2~,N~2~-diethyl-5-nitropyrimidine-2,4-diamine

Catalog ID
STK558272
SMILES CCN(c1nc(N2CCC(CC2)Cc2ccccc2)c(c(n1)N)[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 C20H28N6O2 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N6O2/c1-3-24(4-2)20-22-18(21)17(26(27)28)19(23-20)25-12-10-16(11-13-25)14-15-8-6-5-7-9-15/h5-9,16H,3-4,10-14H2,1-2H3,(H2,21,22,23)
InChIKey
YEVGGSYGCIZNEN-UHFFFAOYSA-N
Synonyms
586987-00-0
(4AMINO5NITRO6(4BENZYLPIPERIDYL)PYRIMIDIN2YL)DIETHYLAMINE
586987000
6(4BENZYLPIPERIDIN1YL)2N2NDIETHYL5NITROPYRIMIDINE24DIAMINE
6(4benzylpiperidin1yl)N~2~N~2~diethyl5nitropyrimidine24diamine
6(4BENZYLPIPERIDIN1YL)N2N2DIETHYL5NITROPYRIMIDINE24DIAMINE
CCN(c1nc(N2CCC(CC2)Cc2ccccc2)c(c(n1)N)(N+)(=O)(O))CC
CCN(CC)C1=NC(=C(C(=N1)N)(N+)(=O)(O))N2CCC(CC2)CC3=CC=CC=C3
InChI=1SC20H28N6O2c1324(42)202218(21)17(26(27)28)19(2320)25121016(111325)14158657915h5916H341014H212H3(H2212223)
MFCD03491704
ZINC000005111733
ZINC05111733
ZINC5111733

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Available files

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