Vitas-M small molecule compound
4-(5-bromothiophen-2-yl)-3-hydroxy-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333313
SMILES Brc1ccc(s1)C1C2=C(CCCC2=O)Nc2c1c(O)n[nH]2
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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 C14H12BrN3O2S MW 366.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrN3O2S/c15-9-5-4-8(21-9)11-10-6(2-1-3-7(10)19)16-13-12(11)14(20)18-17-13/h4-5,11H,1-3H2,(H3,16,17,18,20)InChIKey
VOOMCYSLRQQDDE-UHFFFAOYSA-NSynonyms
4(5bromothiophen2yl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
4(5bromothiophen2yl)3hydroxy146789hexahydro5Hpyrazolo(34b)quinolin5one
Brc1ccc(s1)C1C2=C(CCCC2=O)Nc2c1c(O)n(nH)2
C1CC2=C(C(C3=C(N2)NNC3=O)C4=CC=C(S4)Br)C(=O)C1
InChI=1SC14H12BrN3O2Sc159548(219)11106(2137(10)19)161312(11)14(20)181713h4511H13H2(H316171820)
MFCD09962972
ZINC000012348100
ZINC000012348108
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