Vitas-M small molecule compound
N~2~-(3-methylbutyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK889396
SMILES CC(CCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-])C
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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 C16H22N6O2 MW 330.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N6O2/c1-10(2)7-8-18-16-20-14(17)13(22(23)24)15(21-16)19-12-6-4-5-11(3)9-12/h4-6,9-10H,7-8H2,1-3H3,(H4,17,18,19,20,21)InChIKey
LSHOJFZXLFWKKL-UHFFFAOYSA-NSynonyms
674354-93-9(6AMINO2((3METHYLBUTYL)AMINO)5NITROPYRIMIDIN4YL)(3METHYLPHENYL)AMINE
2N(3METHYLBUTYL)4N(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
674354939
CC(CCNc1nc(Nc2cccc(c2)C)c(c(n1)N)(N+)(=O)(O))C
CC1=CC(=CC=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)NCCC(C)C
InChI=1SC16H22N6O2c110(2)7818162014(17)13(22(23)24)15(2116)191264511(3)912h46910H78H213H3(H41718192021)
MFCD04073477
N~2~(3methylbutyl)N~4~(3methylphenyl)5nitropyrimidine246triamine
N2(3METHYLBUTYL)N4(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
N2isopentyl5nitroN4(mtolyl)pyrimidine246triamine
ZINC000005163893
ZINC05163893
ZINC5163893
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