Vitas-M small molecule compound
N,N'-bis(4-ethoxybenzyl)-5-nitropyrimidine-4,6-diamine
Catalog ID
STK836457
SMILES CCOc1ccc(cc1)CNc1ncnc(c1[N+](=O)[O-])NCc1ccc(cc1)OCC
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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 C22H25N5O4 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4/c1-3-30-18-9-5-16(6-10-18)13-23-21-20(27(28)29)22(26-15-25-21)24-14-17-7-11-19(12-8-17)31-4-2/h5-12,15H,3-4,13-14H2,1-2H3,(H2,23,24,25,26)InChIKey
UQVQOSVDKQZTKG-UHFFFAOYSA-NSynonyms
((4ETHOXYPHENYL)METHYL)(6(((4ETHOXYPHENYL)METHYL)AMINO)5NITROPYRIMIDIN4YL)AMINE
4N6NBIS((4ETHOXYPHENYL)METHYL)5NITROPYRIMIDINE46DIAMINE
CCOC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=C(C=C3)OCC)(N+)(=O)(O)
CCOc1ccc(cc1)CNc1ncnc(c1(N+)(=O)(O))NCc1ccc(cc1)OCC
InChI=1SC22H25N5O4c1330189516(61018)13232120(27(28)29)22(26152521)24141771119(12817)3142h51215H341314H212H3(H223242526)
MFCD00330638
N4N6bis(4ethoxybenzyl)5nitropyrimidine46diamine
NNbis(4ethoxybenzyl)5nitropyrimidine46diamine
ZINC000004596861
ZINC04596861
ZINC4596861
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