Vitas-M small molecule compound

(4-bromophenyl)(6-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone

Catalog ID
STK050661
SMILES COc1cccc2c1N(C(=O)c1ccc(cc1)Br)C(c1c2c(=S)ss1)(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 C20H16BrNO2S3 MW 478.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrNO2S3/c1-20(2)17-15(19(25)27-26-17)13-5-4-6-14(24-3)16(13)22(20)18(23)11-7-9-12(21)10-8-11/h4-10H,1-3H3
InChIKey
FGRKKXPITHAHIP-UHFFFAOYSA-N
Synonyms
331870-28-1
(4BROMOPHENYL)(6METHOXY44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)METHANONE
(4BROMOPHENYL)(6METHOXY44DIMETHYL1THIOXO14DIHYDRO5H(12)DITHIOLO(34C)QUINOLIN5YL)METHANONE
(4bromophenyl)(6methoxy44dimethyl1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)methanone
331870281
4BROMOPHENYL6METHOXY44DIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL)KETONE
5(4BROMOBENZOYL)6METHOXY44DIMETHYL45DIHYDRO1H(12)DITHIOLO(34C)QUINOLINE1THIONE
CC1(C2=C(C3=C(N1C(=O)C4=CC=C(C=C4)Br)C(=CC=C3)OC)C(=S)SS2)C
COc1cccc2c1N(C(=O)c1ccc(cc1)Br)C(c1c2c(=S)ss1)(C)C
InChI=1SC20H16BrNO2S3c120(2)1715(19(25)272617)1354614(243)16(13)22(20)18(23)117912(21)10811h410H13H3
MFCD01068067
STK050661
ZINC000002346395
ZINC02346395
ZINC2346395

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.