Vitas-M small molecule compound
N~4~-cyclohexyl-N~2~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK557225
SMILES COc1ccc(cc1)Nc1nc(N)c(c(n1)NC1CCCCC1)[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 C17H22N6O3 MW 358.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O3/c1-26-13-9-7-12(8-10-13)20-17-21-15(18)14(23(24)25)16(22-17)19-11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H4,18,19,20,21,22)InChIKey
VZAPEIIJQBNTTR-UHFFFAOYSA-NSynonyms
578003-77-7(4AMINO6(CYCLOHEXYLAMINO)5NITROPYRIMIDIN2YL)(4METHOXYPHENYL)AMINE
4NCYCLOHEXYL2N(4METHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
578003777
COC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3CCCCC3)(N+)(=O)(O))N
COc1ccc(cc1)Nc1nc(N)c(c(n1)NC1CCCCC1)(N+)(=O)(O)
InChI=1SC17H22N6O3c126139712(81013)20172115(18)14(23(24)25)16(2217)19115324611h711H26H21H3(H41819202122)
MFCD04023690
N~4~cyclohexylN~2~(4methoxyphenyl)5nitropyrimidine246triamine
N4CYCLOHEXYLN2(4METHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000005032727
ZINC05032727
ZINC5032727
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