Vitas-M small molecule compound

N,N'-bis(2-ethylphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine

Catalog ID
STL170449
SMILES CCc1ccccc1Nc1nc(C)c(c(n1)Nc1ccccc1CC)[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 C21H23N5O2 MW 377.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2/c1-4-15-10-6-8-12-17(15)23-20-19(26(27)28)14(3)22-21(25-20)24-18-13-9-7-11-16(18)5-2/h6-13H,4-5H2,1-3H3,(H2,22,23,24,25)
InChIKey
SSRUMWZKFMZUHJ-UHFFFAOYSA-N
Synonyms

24BIS(2ETHYLANILINO)5NITRO6METHYLPYRIMIDINE
2N4NBIS(2ETHYLPHENYL)6METHYL5NITROPYRIMIDINE24DIAMINE
CCC1=CC=CC=C1NC2=NC(=NC(=C2(N+)(=O)(O))C)NC3=CC=CC=C3CC
CCc1ccccc1Nc1nc(C)c(c(n1)Nc1ccccc1CC)(N+)(=O)(O)
InChI=1SC21H23N5O2c141510681217(15)232019(26(27)28)14(3)2221(2520)241813971116(18)52h613H45H213H3(H222232425)
MFCD01053905
NNbis(2ethylphenyl)6methyl5nitropyrimidine24diamine
ZINC000004619069
ZINC04619069
ZINC4619069

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.