Vitas-M small molecule compound
2-(azepan-1-yl)-N-benzyl-5-nitropyrimidine-4,6-diamine
Catalog ID
STK553058
SMILES [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1N)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 C17H22N6O2 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O2/c18-15-14(23(24)25)16(19-12-13-8-4-3-5-9-13)21-17(20-15)22-10-6-1-2-7-11-22/h3-5,8-9H,1-2,6-7,10-12H2,(H3,18,19,20,21)InChIKey
SNIWPQGXICOOQS-UHFFFAOYSA-NSynonyms
836652-51-8(6AMINO2AZAPERHYDROEPINYL5NITROPYRIMIDIN4YL)BENZYLAMINE
(O)(N+)(=O)c1c(NCc2ccccc2)nc(nc1N)N1CCCCCC1
2(AZEPAN1YL)4NBENZYL5NITROPYRIMIDINE46DIAMINE
2(azepan1yl)N4benzyl5nitropyrimidine46diamine
2(azepan1yl)Nbenzyl5nitropyrimidine46diamine
2AZEPAN1YLNBENZYL5NITROPYRIMIDINE46DIAMINE
836652518
C1CCCN(CC1)C2=NC(=C(C(=N2)NCC3=CC=CC=C3)(N+)(=O)(O))N
InChI=1SC17H22N6O2c181514(23(24)25)16(1912138435913)2117(2015)221061271122h3589H12671012H2(H318192021)
MFCD03491773
ZINC000005068633
ZINC05068633
ZINC5068633
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