Vitas-M small molecule compound
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-ethoxyphenyl)-6-methyl-5-nitropyrimidin-4-amine
Catalog ID
STL433034
SMILES CCOc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])C)n1nc(cc1C)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 C18H20N6O3 MW 368.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O3/c1-5-27-15-8-6-14(7-9-15)20-17-16(24(25)26)13(4)19-18(21-17)23-12(3)10-11(2)22-23/h6-10H,5H2,1-4H3,(H,19,20,21)InChIKey
XQPYABLGWCBCNB-UHFFFAOYSA-NSynonyms
2(35dimethyl1Hpyrazol1yl)N(4ethoxyphenyl)6methyl5nitropyrimidin4amine
2(35dimethylpyrazol1yl)N(4ethoxyphenyl)6methyl5nitropyrimidin4amine
CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))C)N3C(=CC(=N3)C)C
CCOc1ccc(cc1)Nc1nc(nc(c1(N+)(=O)(O))C)n1nc(cc1C)C
InChI=1SC18H20N6O3c1527158614(7915)201716(24(25)26)13(4)1918(2117)2312(3)1011(2)2223h610H5H214H3(H192021)
MFCD13899622
ZINC000016691782
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