Vitas-M small molecule compound
1-[3-({4-methyl-6-[methyl(phenyl)amino]-5-nitropyrimidin-2-yl}amino)phenyl]ethanone
Catalog ID
STL169099
SMILES [O-][N+](=O)c1c(C)nc(nc1N(c1ccccc1)C)Nc1cccc(c1)C(=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 C20H19N5O3 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3/c1-13-18(25(27)28)19(24(3)17-10-5-4-6-11-17)23-20(21-13)22-16-9-7-8-15(12-16)14(2)26/h4-12H,1-3H3,(H,21,22,23)InChIKey
VVHGRAVEVYXIQZ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1c(C)nc(nc1N(c1ccccc1)C)Nc1cccc(c1)C(=O)C
1(3((4METHYL6(METHYL(PHENYL)AMINO)5NITROPYRIMIDIN2YL)AMINO)PHENYL)ETHAN1ONE
1(3((4methyl6(methyl(phenyl)amino)5nitropyrimidin2yl)amino)phenyl)ethanone
1(3((4METHYL6(NMETHYLANILINO)5NITROPYRIMIDIN2YL)AMINO)PHENYL)ETHANONE
CC1=C(C(=NC(=N1)NC2=CC=CC(=C2)C(=O)C)N(C)C3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC20H19N5O3c11318(25(27)28)19(24(3)17105461117)2320(2113)221697815(1216)14(2)26h412H13H3(H212223)
MFCD01032309
ZINC000004719471
ZINC04719471
ZINC4719471
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