Vitas-M small molecule compound
5-(2-hydroxy-5-nitrophenyl)-1,3-dimethyl-5,5a-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
Catalog ID
STK011638
SMILES Oc1ccc(cc1C1C2C(=O)c3c(C2=Nc2c1c(=O)n(C)c(=O)n2C)cccc3)[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 C22H16N4O6 MW 432.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O6/c1-24-20-17(21(29)25(2)22(24)30)15(13-9-10(26(31)32)7-8-14(13)27)16-18(23-20)11-5-3-4-6-12(11)19(16)28/h3-9,15-16,27H,1-2H3InChIKey
STBQPUKVEJMZMN-UHFFFAOYSA-NSynonyms
5(2hydroxy5nitrophenyl)13dimethyl55adihydro1Hindeno(2156)pyrido(23d)pyrimidine246(3H)trione
CN1C2=C(C(C3C(=N2)C4=CC=CC=C4C3=O)C5=C(C=CC(=C5)(N+)(=O)(O))O)C(=O)N(C1=O)C
InChI=1SC22H16N4O6c1242017(21(29)25(2)22(24)30)15(13910(26(31)32)7814(13)27)1618(2320)11534612(11)19(16)28h39151627H12H3
MFCD01051613
Oc1ccc(cc1C1C2C(=O)c3c(C2=Nc2c1c(=O)n(C)c(=O)n2C)cccc3)(N+)(=O)(O)
STK011638
ZINC000002483874
ZINC000008456489
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