Vitas-M small molecule compound

1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]ethanone

Catalog ID
STK217521
SMILES CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CSc1nccc(n1)C)(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 C21H21N3O2S4 MW 475.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S4/c1-5-26-13-6-7-15-14(10-13)17-18(29-30-19(17)27)21(3,4)24(15)16(25)11-28-20-22-9-8-12(2)23-20/h6-10H,5,11H2,1-4H3
InChIKey
QYLFHVNJQGJEEX-UHFFFAOYSA-N
Synonyms
774561-84-1
1(8ETHOXY44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)2(4METHYLPYRIMIDIN2YL)SULFANYLETHANONE
1(8ETHOXY44DIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL))2(4METHYLPYRIMIDIN2YLTHIO)ETHAN1ONE
1(8ethoxy44dimethyl1thioxo14dihydro5H(12)dithiolo(34c)quinolin5yl)2((4methylpyrimidin2yl)sulfanyl)ethanone
1(8ethoxy44dimethyl1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)2((4methylpyrimidin2yl)thio)ethanone
774561841
CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CSC4=NC=CC(=N4)C
InChI=1SC21H21N3O2S4c152613671514(1013)1718(293019(17)27)21(34)24(15)16(25)112820229812(2)2320h610H511H214H3
MFCD06602056
ZINC000002230780
ZINC02230780
ZINC2230780

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Available files

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