Vitas-M small molecule compound
N~2~-(3,4-dimethylphenyl)-5-nitro-N~4~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4,6-triamine
Catalog ID
STK558431
SMILES [O-][N+](=O)c1c(NCC2CCCO2)nc(nc1N)Nc1ccc(c(c1)C)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 C17H22N6O3 MW 358.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O3/c1-10-5-6-12(8-11(10)2)20-17-21-15(18)14(23(24)25)16(22-17)19-9-13-4-3-7-26-13/h5-6,8,13H,3-4,7,9H2,1-2H3,(H4,18,19,20,21,22)InChIKey
JKEWGBJXQXXVLM-UHFFFAOYSA-NSynonyms
586994-07-2(6AMINO2((34DIMETHYLPHENYL)AMINO)5NITROPYRIMIDIN4YL)(OXOLAN2YLMETHYL)AMINE
(O)(N+)(=O)c1c(NCC2CCCO2)nc(nc1N)Nc1ccc(c(c1)C)C
2N(34DIMETHYLPHENYL)5NITRO4N(OXOLAN2YLMETHYL)PYRIMIDINE246TRIAMINE
586994072
CC1=C(C=C(C=C1)NC2=NC(=C(C(=N2)NCC3CCCO3)(N+)(=O)(O))N)C
InChI=1SC17H22N6O3c1105612(811(10)2)20172115(18)14(23(24)25)16(2217)199134372613h56813H3479H212H3(H41819202122)
MFCD04032126
N~2~(34dimethylphenyl)5nitroN~4~(tetrahydrofuran2ylmethyl)pyrimidine246triamine
N2(34dimethylphenyl)5nitroN4((tetrahydrofuran2yl)methyl)pyrimidine246triamine
N2(34DIMETHYLPHENYL)5NITRON4(TETRAHYDROFURAN2YLMETHYL)PYRIMIDINE246TRIAMINE
ZINC000004306165
ZINC000004306166
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