Vitas-M small molecule compound
6-(azepan-1-yl)-2-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Catalog ID
STK557811
SMILES CCN1CCN(CC1)c1nc(N)c(c(n1)N1CCCCCC1)[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 C16H27N7O2 MW 349.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27N7O2/c1-2-20-9-11-22(12-10-20)16-18-14(17)13(23(24)25)15(19-16)21-7-5-3-4-6-8-21/h2-12H2,1H3,(H2,17,18,19)InChIKey
SMRJCVJKVNYBBJ-UHFFFAOYSA-NSynonyms
585549-25-3585549253
6(azepan1yl)2(4ethylpiperazin1yl)5nitropyrimidin4amine
6AZAPERHYDROEPINYL2(4ETHYLPIPERAZINYL)5NITROPYRIMIDINE4YLAMINE
6AZEPAN1YL2(4ETHYLPIPERAZIN1YL)5NITROPYRIMIDIN4AMINE
CCN1CCN(CC1)c1nc(N)c(c(n1)N1CCCCCC1)(N+)(=O)(O)
CCN1CCN(CC1)C2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCCCCC3
InChI=1SC16H27N7O2c122091122(121020)161814(17)13(23(24)25)15(1916)2175346821h212H21H3(H2171819)
MFCD04027942
ZINC000005050382
ZINC5050382
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