Vitas-M small molecule compound

N~2~-cyclohexyl-N~4~-(2,5-dimethoxyphenyl)-5-nitropyrimidine-2,4,6-triamine

Catalog ID
STK889521
SMILES COc1ccc(cc1Nc1nc(NC2CCCCC2)nc(c1[N+](=O)[O-])N)OC

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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 C18H24N6O4 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N6O4/c1-27-12-8-9-14(28-2)13(10-12)21-17-15(24(25)26)16(19)22-18(23-17)20-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H4,19,20,21,22,23)
InChIKey
FNKWUIBYTDUWQU-UHFFFAOYSA-N
Synonyms
713086-01-2
(6AMINO2(CYCLOHEXYLAMINO)5NITROPYRIMIDIN4YL)(25DIMETHOXYPHENYL)AMINE
2NCYCLOHEXYL4N(25DIMETHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
713086012
COC1=CC(=C(C=C1)OC)NC2=NC(=NC(=C2(N+)(=O)(O))N)NC3CCCCC3
COc1ccc(cc1Nc1nc(NC2CCCCC2)nc(c1(N+)(=O)(O))N)OC
InChI=1SC18H24N6O4c127128914(282)13(1012)211715(24(25)26)16(19)2218(2317)20116435711h811H37H212H3(H41920212223)
MFCD04161545
N~2~cyclohexylN~4~(25dimethoxyphenyl)5nitropyrimidine246triamine
N2CYCLOHEXYLN4(25DIMETHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000006274943
ZINC06274943
ZINC6274943

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Available files

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