Vitas-M small molecule compound
6-(azepan-1-yl)-N~2~-methyl-5-nitro-N~2~-phenylpyrimidine-2,4-diamine
Catalog ID
STK555465
SMILES [O-][N+](=O)c1c(N)nc(nc1N1CCCCCC1)N(c1ccccc1)C
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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 C17H22N6O2 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O2/c1-21(13-9-5-4-6-10-13)17-19-15(18)14(23(24)25)16(20-17)22-11-7-2-3-8-12-22/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H2,18,19,20)InChIKey
PNGOQSXNWGXMLT-UHFFFAOYSA-NSynonyms
673441-44-6(4AMINO6(AZEPAN1YL)5NITROPYRIMIDIN2YL)METHYLPHENYLAMINE
(4AMINO6AZAPERHYDROEPINYL5NITROPYRIMIDIN2YL)METHYLPHENYLAMINE
(O)(N+)(=O)c1c(N)nc(nc1N1CCCCCC1)N(c1ccccc1)C
6(1AZEPANYL)N2METHYL5NITRON2PHENYLPYRIMIDINE24DIAMINE
6(AZEPAN1YL)2NMETHYL5NITRO2NPHENYLPYRIMIDINE24DIAMINE
6(azepan1yl)N~2~methyl5nitroN~2~phenylpyrimidine24diamine
6(AZEPAN1YL)N2METHYL5NITRON2PHENYLPYRIMIDINE24DIAMINE
673441446
6AZEPAN1YLN2METHYL5NITRON2PHENYLPYRIMIDINE24DIAMINE
CN(C1=CC=CC=C1)C2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCCCCC3
InChI=1SC17H22N6O2c121(1395461013)171915(18)14(23(24)25)16(2017)221172381222h46910H23781112H21H3(H2181920)
MFCD04011372
ZINC000005025364
ZINC05025364
ZINC5025364
Check stock
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Check stock on Vitas-MAvailable files
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