Vitas-M small molecule compound
6-(4-benzylpiperazin-1-yl)-N~2~-methyl-5-nitropyrimidine-2,4-diamine
Catalog ID
STL056778
SMILES CNc1nc(N)c(c(n1)N1CCN(CC1)Cc1ccccc1)[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 C16H21N7O2 MW 343.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N7O2/c1-18-16-19-14(17)13(23(24)25)15(20-16)22-9-7-21(8-10-22)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H3,17,18,19,20)InChIKey
UQJHNJVFZJSWDC-UHFFFAOYSA-NSynonyms
714253-40-46(4BENZYLPIPERAZIN1YL)2NMETHYL5NITROPYRIMIDINE24DIAMINE
6(4benzylpiperazin1yl)N~2~methyl5nitropyrimidine24diamine
6(4BENZYLPIPERAZIN1YL)N2METHYL5NITROPYRIMIDINE24DIAMINE
714253404
CNC1=NC(=C(C(=N1)N)(N+)(=O)(O))N2CCN(CC2)CC3=CC=CC=C3
CNc1nc(N)c(c(n1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC16H21N7O2c118161914(17)13(23(24)25)15(2016)229721(81022)11125324612h26H711H21H3(H317181920)
MFCD04160896
ZINC000057463212
ZINC57463212
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