Vitas-M small molecule compound
7,7-dimethyl-4-(5-nitrofuran-2-yl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333462
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(o1)[N+](=O)[O-])c1c(N2)[nH]n(c1=O)c1ccccc1
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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 C22H20N4O5 MW 420.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O5/c1-22(2)10-13-17(14(27)11-22)18(15-8-9-16(31-15)26(29)30)19-20(23-13)24-25(21(19)28)12-6-4-3-5-7-12/h3-9,18,23-24H,10-11H2,1-2H3InChIKey
GKQRZYQEMSECPQ-UHFFFAOYSA-NSynonyms
77dimethyl4(5nitrofuran2yl)2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
77dimethyl4(5nitrofuran2yl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC=C(O5)(N+)(=O)(O))C(=O)C1)C
InChI=1SC22H20N4O5c122(2)101317(14(27)1122)18(158916(3115)26(29)30)1920(2313)2425(21(19)28)126435712h39182324H1011H212H3
MFCD09963079
O=C1CC(C)(C)CC2=C1C(c1ccc(o1)(N+)(=O)(O))c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000018195857
ZINC000018195859
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