Vitas-M small molecule compound
4-(1H-imidazol-2-yl)-7,7-dimethyl-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333463
SMILES O=C1CC(C)(C)CC2=C1C(c1ncc[nH]1)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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-21(2)10-13-15(14(27)11-21)16(18-22-8-9-23-18)17-19(24-13)25-26(20(17)28)12-6-4-3-5-7-12/h3-9,16,24-25H,10-11H2,1-2H3,(H,22,23)InChIKey
AUUKQDPTMSTKNL-UHFFFAOYSA-NSynonyms
4(1Himidazol2yl)77dimethyl2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
4(1Himidazol2yl)77dimethyl2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=NC=CN5)C(=O)C1)C
InChI=1SC21H21N5O2c121(2)101315(14(27)1121)16(1822892318)1719(2413)2526(20(17)28)126435712h39162425H1011H212H3(H2223)
MFCD09963080
O=C1CC(C)(C)CC2=C1C(c1ncc(nH)1)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000012348722
ZINC000012348729
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