Vitas-M small molecule compound

4,4,5,8-tetramethyl-1-[(phenylcarbonyl)sulfanyl]-4,5-dihydro[1,2]dithiolo[3,4-c]quinolin-2-ium

Catalog ID
STL147241
SMILES Cc1ccc2c(c1)c1c([s+]sc1C(N2C)(C)C)SC(=O)c1ccccc1

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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 C21H20NOS3 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20NOS3/c1-13-10-11-16-15(12-13)17-18(21(2,3)22(16)4)25-26-20(17)24-19(23)14-8-6-5-7-9-14/h5-12H,1-4H3/q+1
InChIKey
IAOXPWCCNOOKSK-UHFFFAOYSA-N
Synonyms

1(benzoylthio)4458tetramethyl45dihydro(12)dithiolo(34c)quinolin2iumchloride
4458tetramethyl1((phenylcarbonyl)sulfanyl)45dihydro(12)dithiolo(34c)quinolin2ium
benzoyl(4458tetramethyldithiolo(34c)quinolin1ylidene)sulfanium
CC1=CC2=C(C=C1)N(C(C3=C2C(=(S+)C(=O)C4=CC=CC=C4)SS3)(C)C)C
Cc1ccc2c(c1)c1c((s+)sc1C(N2C)(C)C)SC(=O)c1ccccc1
Cc1ccc2c(c1)c1c((s+)sc1C(N2C)(C)C)SC(=O)c1ccccc1(Cl)
InChI=1SC21H20NOS3c11310111615(1213)1718(21(23)22(16)4)252620(17)2419(23)148657914h512H14H3q+1
MFCD00635205
ZINC000004995112
ZINC04995112
ZINC4995112

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Available files

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