Vitas-M small molecule compound
6-bromo-7,7-dimethyl-2-(methylsulfanyl)-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK546746
SMILES CSc1nc2CC(C)(C)C(C(=O)c2cc1C#N)Br
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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 C13H13BrN2OS MW 325.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN2OS/c1-13(2)5-9-8(10(17)11(13)14)4-7(6-15)12(16-9)18-3/h4,11H,5H2,1-3H3InChIKey
IUXMYQSYAAGQIT-UHFFFAOYSA-NSynonyms
518035-84-2518035842
6bromo77dimethyl2(methylsulfanyl)5oxo5678tetrahydroquinoline3carbonitrile
6bromo77dimethyl2(methylthio)5oxo5678tetrahydroquinoline3carbonitrile
6BROMO77DIMETHYL2METHYLSULFANYL5OXO68DIHYDROQUINOLINE3CARBONITRILE
CC1(CC2=C(C=C(C(=N2)SC)C#N)C(=O)C1Br)C
InChI=1SC13H13BrN2OSc113(2)598(10(17)11(13)14)47(615)12(169)183h411H5H213H3
MFCD03666210
ZINC000004994271
ZINC000004994275
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