Vitas-M small molecule compound
4,7,7-trimethyl-5-oxo-2-thioxo-1,2,3,4,5,6,7,8-octahydroquinoline-3-carbonitrile
Catalog ID
STL324473
SMILES N#CC1C(=S)NC2=C(C1C)C(=O)CC(C2)(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 C13H16N2OS MW 248.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2OS/c1-7-8(6-14)12(17)15-9-4-13(2,3)5-10(16)11(7)9/h7-8H,4-5H2,1-3H3,(H,15,17)InChIKey
QFQJDPSEYXZOSD-UHFFFAOYSA-NSynonyms
221217-26-1221217261
477trimethyl5oxo2sulfanylidene3468tetrahydro1Hquinoline3carbonitrile
477trimethyl5oxo2thioxo12345678octahydroquinoline3carbonitrile
CC1C(C(=S)NC2=C1C(=O)CC(C2)(C)C)C#N
InChI=1SC13H16N2OSc178(614)12(17)159413(23)510(16)11(7)9h78H45H213H3(H1517)
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