Vitas-M small molecule compound
6-(4-benzylpiperazin-1-yl)-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4-diamine
Catalog ID
STL252644
SMILES CN(c1nc(N)c(c(n1)N1CCN(CC1)Cc1ccccc1)[N+](=O)[O-])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 C17H23N7O2 MW 357.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N7O2/c1-21(2)17-19-15(18)14(24(25)26)16(20-17)23-10-8-22(9-11-23)12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H2,18,19,20)InChIKey
LBFLMUYNBZLOAM-UHFFFAOYSA-NSynonyms
672338-84-0(4AMINO5NITRO6(4BENZYLPIPERAZINYL)PYRIMIDIN2YL)DIMETHYLAMINE
6(4BENZYLPIPERAZIN1YL)2N2NDIMETHYL5NITROPYRIMIDINE24DIAMINE
6(4benzylpiperazin1yl)N~2~N~2~dimethyl5nitropyrimidine24diamine
6(4BENZYLPIPERAZIN1YL)N2N2DIMETHYL5NITROPYRIMIDINE24DIAMINE
672338840
CN(C)C1=NC(=C(C(=N1)N)(N+)(=O)(O))N2CCN(CC2)CC3=CC=CC=C3
CN(c1nc(N)c(c(n1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O))C
InChI=1SC17H23N7O2c121(2)171915(18)14(24(25)26)16(2017)2310822(91123)12136435713h37H812H212H3(H2181920)
MFCD04074710
ZINC000054147645
ZINC54147645
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