Vitas-M small molecule compound

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

Catalog ID
STK010091
SMILES COc1cccc2c1N(C(=O)c1ccc(cc1)C(C)(C)C)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 C24H25NO2S3 MW 455.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO2S3/c1-23(2,3)15-12-10-14(11-13-15)21(26)25-19-16(8-7-9-17(19)27-6)18-20(24(25,4)5)29-30-22(18)28/h7-13H,1-6H3
InChIKey
XAFVHBPLCWFFMW-UHFFFAOYSA-N
Synonyms
332073-89-9
(4(tertbutyl)phenyl)(6methoxy44dimethyl1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)methanone
(4TERTBUTYLPHENYL)(6METHOXY44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)METHANONE
(4TERTBUTYLPHENYL)(6METHOXY44DIMETHYL1THIOXO14DIHYDRO5H(12)DITHIOLO(34C)QUINOLIN5YL)METHANONE
332073899
4(TERTBUTYL)PHENYL6METHOXY44DIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL)KETONE
CC1(C2=C(C3=C(N1C(=O)C4=CC=C(C=C4)C(C)(C)C)C(=CC=C3)OC)C(=S)SS2)C
COc1cccc2c1N(C(=O)c1ccc(cc1)C(C)(C)C)C(c1c2c(=S)ss1)(C)C
InChI=1SC24H25NO2S3c123(23)15121014(111315)21(26)251916(87917(19)276)1820(24(254)5)293022(18)28h713H16H3
MFCD01543014
STK010091
ZINC000002260656
ZINC02260656
ZINC2260656

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Available files

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