Vitas-M small molecule compound
2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
Catalog ID
STK844030
SMILES COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCCC1
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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 C17H22N6O3 MW 358.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O3/c1-26-13-8-6-12(7-9-13)19-16-14(23(24)25)15(18)20-17(21-16)22-10-4-2-3-5-11-22/h6-9H,2-5,10-11H2,1H3,(H3,18,19,20,21)InChIKey
MRJABXIKCDNHML-UHFFFAOYSA-NSynonyms
799834-43-8(6AMINO2AZAPERHYDROEPINYL5NITROPYRIMIDIN4YL)(4METHOXYPHENYL)AMINE
2(AZEPAN1YL)4N(4METHOXYPHENYL)5NITROPYRIMIDINE46DIAMINE
2(azepan1yl)N(4methoxyphenyl)5nitropyrimidine46diamine
2(azepan1yl)N4(4methoxyphenyl)5nitropyrimidine46diamine
799834438
COC1=CC=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)N3CCCCCC3
COc1ccc(cc1)Nc1nc(nc(c1(N+)(=O)(O))N)N1CCCCCC1
InChI=1SC17H22N6O3c126138612(7913)191614(23(24)25)15(18)2017(2116)221042351122h69H251011H21H3(H318192021)
MFCD03684968
ZINC000004306121
ZINC04306121
ZINC4306121
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