Vitas-M small molecule compound
dimethyl 2-(1,2,2,6-tetramethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK091192
SMILES COC(=O)C1=C(S/C(=C\2/c3cc(C)ccc3N(C(C2=S)(C)C)C)/S1)C(=O)OC
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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 C20H21NO4S3 MW 435.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4S3/c1-10-7-8-12-11(9-10)13(16(26)20(2,3)21(12)4)19-27-14(17(22)24-5)15(28-19)18(23)25-6/h7-9H,1-6H3InChIKey
DBQWLNUEQQKHKQ-UHFFFAOYSA-NSynonyms
351370-87-1351370871
CC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C
COC(=O)C1=C(SC(=C2c3cc(C)ccc3N(C(C2=S)(C)C)C)S1)C(=O)OC
dimethyl2(1226tetramethyl3sulfanylidenequinolin4ylidene)13dithiole45dicarboxylate
dimethyl2(1226tetramethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC20H21NO4S3c110781211(910)13(16(26)20(23)21(12)4)192714(17(22)245)15(2819)18(23)256h79H16H3
MFCD01220741
STK091192
ZINC000004046801
ZINC04046801
ZINC4046801
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