Vitas-M small molecule compound
4-(5-bromothiophen-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
STK333311
SMILES Brc1ccc(s1)C1C2=C(Nc3c1c(=O)n([nH]3)c1ccccc1)CC(CC2=O)(C)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 C22H20BrN3O2S MW 470.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O2S/c1-22(2)10-13-17(14(27)11-22)18(15-8-9-16(23)29-15)19-20(24-13)25-26(21(19)28)12-6-4-3-5-7-12/h3-9,18,24-25H,10-11H2,1-2H3InChIKey
RPFJCJZQUIALIN-UHFFFAOYSA-NSynonyms
4(5bromothiophen2yl)77dimethyl2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
4(5bromothiophen2yl)77dimethyl2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
Brc1ccc(s1)C1C2=C(Nc3c1c(=O)n((nH)3)c1ccccc1)CC(CC2=O)(C)C
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC=C(S5)Br)C(=O)C1)C
InChI=1SC22H20BrN3O2Sc122(2)101317(14(27)1122)18(158916(23)2915)1920(2413)2526(21(19)28)126435712h39182425H1011H212H3
MFCD09962970
ZINC000012348070
ZINC000012348077
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