Vitas-M small molecule compound

2-(4-fluorophenoxy)-1-(4,4,7-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone

Catalog ID
STK789095
SMILES Fc1ccc(cc1)OCC(=O)N1c2cc(C)ccc2c2c(C1(C)C)ssc2=S

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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 C21H18FNO2S3 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FNO2S3/c1-12-4-9-15-16(10-12)23(21(2,3)19-18(15)20(26)28-27-19)17(24)11-25-14-7-5-13(22)6-8-14/h4-10H,11H2,1-3H3
InChIKey
XQGIARMPSSGWKQ-UHFFFAOYSA-N
Synonyms
303740-44-5
2(4FLUOROPHENOXY)1(447TRIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)ETHANONE
2(4FLUOROPHENOXY)1(447TRIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL))ETHAN1ONE
2(4fluorophenoxy)1(447trimethyl1thioxo14dihydro5H(12)dithiolo(34c)quinolin5yl)ethanone
2(4fluorophenoxy)1(447trimethyl1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)ethanone
303740445
CC1=CC2=C(C=C1)C3=C(C(N2C(=O)COC4=CC=C(C=C4)F)(C)C)SSC3=S
InChI=1SC21H18FNO2S3c112491516(1012)23(21(23)1918(15)20(26)282719)17(24)1125147513(22)6814h410H11H213H3
MFCD00616834
ZINC000001830896
ZINC01830896
ZINC1830896

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Available files

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