Vitas-M small molecule compound
N~4~-cyclohexyl-N~2~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK858782
SMILES Cc1cccc(c1)Nc1nc(NC2CCCCC2)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 C17H22N6O2 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O2/c1-11-6-5-9-13(10-11)20-17-21-15(18)14(23(24)25)16(22-17)19-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H4,18,19,20,21,22)InChIKey
DMYMFQZTHRXOHN-UHFFFAOYSA-NSynonyms
672936-01-5(6AMINO2((3METHYLPHENYL)AMINO)5NITROPYRIMIDIN4YL)CYCLOHEXYLAMINE
4NCYCLOHEXYL2N(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
672936015
CC1=CC(=CC=C1)NC2=NC(=C(C(=N2)NC3CCCCC3)(N+)(=O)(O))N
Cc1cccc(c1)Nc1nc(NC2CCCCC2)c(c(n1)N)(N+)(=O)(O)
InChI=1SC17H22N6O2c11165913(1011)20172115(18)14(23(24)25)16(2217)19127324812h5691012H2478H21H3(H41819202122)
MFCD04078442
N~4~cyclohexylN~2~(3methylphenyl)5nitropyrimidine246triamine
N4cyclohexyl5nitroN2(mtolyl)pyrimidine246triamine
N4CYCLOHEXYLN2(3METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000005180028
ZINC05180028
ZINC5180028
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