Vitas-M small molecule compound
3-hydroxy-4-[4-(methylsulfanyl)phenyl]-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333144
SMILES CSc1ccc(cc1)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 C17H17N3O2S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O2S/c1-23-10-7-5-9(6-8-10)13-14-11(3-2-4-12(14)21)18-16-15(13)17(22)20-19-16/h5-8,13H,2-4H2,1H3,(H3,18,19,20,22)InChIKey
PTJSGRZVMCHBPK-UHFFFAOYSA-NSynonyms
3hydroxy4(4(methylsulfanyl)phenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
4(4methylsulfanylphenyl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
CSC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC4=C2C(=O)NN4
CSc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(O)n(nH)2
InChI=1SC17H17N3O2Sc12310759(6810)131411(32412(14)21)181615(13)17(22)201916h5813H24H21H3(H318192022)
MFCD09962855
ZINC000012347185
ZINC000012347195
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