Vitas-M small molecule compound

N~2~-(2-methoxyethyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine

Catalog ID
STK552935
SMILES COCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[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 C14H18N6O3 MW 318.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N6O3/c1-9-4-3-5-10(8-9)17-13-11(20(21)22)12(15)18-14(19-13)16-6-7-23-2/h3-5,8H,6-7H2,1-2H3,(H4,15,16,17,18,19)
InChIKey
JUXKLPLSSGOWKX-UHFFFAOYSA-N
Synonyms
836635-22-4
(6AMINO2((2METHOXYETHYL)AMINO)5NITROPYRIMIDIN4YL)(3METHYLPHENYL)AMINE
2N(2METHOXYETHYL)4N(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
836635224
CC1=CC(=CC=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)NCCOC
COCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)(N+)(=O)(O)
InChI=1SC14H18N6O3c1943510(89)171311(20(21)22)12(15)1814(1913)1667232h358H67H212H3(H41516171819)
MFCD03689600
N~2~(2methoxyethyl)N~4~(3methylphenyl)5nitropyrimidine246triamine
N2(2methoxyethyl)5nitroN4(mtolyl)pyrimidine246triamine
N2(2METHOXYETHYL)N4(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000005066041
ZINC05066041
ZINC5066041

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Available files

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