Vitas-M small molecule compound
dimethyl 2-[2,2-dimethyl-1-(3-methylbutanoyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK870831
SMILES COC(=O)C1=C(S/C(=C\2/c3ccccc3N(C(C2=S)(C)C)C(=O)CC(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 C23H25NO5S3 MW 491.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5S3/c1-12(2)11-15(25)24-14-10-8-7-9-13(14)16(19(30)23(24,3)4)22-31-17(20(26)28-5)18(32-22)21(27)29-6/h7-10,12H,11H2,1-6H3InChIKey
PQXLOSGSOGOANM-UHFFFAOYSA-NSynonyms
331260-62-9331260629
CC(C)CC(=O)N1C2=CC=CC=C2C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C
COC(=O)C1=C(SC(=C2c3ccccc3N(C(C2=S)(C)C)C(=O)CC(C)C)S1)C(=O)OC
DIMETHYL2(22DIMETHYL1(3METHYLBUTANOYL)3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(22DIMETHYL1(3METHYLBUTANOYL)3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(22dimethyl1(3methylbutanoyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC23H25NO5S3c112(2)1115(25)24141087913(14)16(19(30)23(243)4)223117(20(26)285)18(3222)21(27)296h71012H11H216H3
MFCD00616852
ZINC000008386985
ZINC08386985
ZINC8386985
Check stock
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Check stock on Vitas-MAvailable files
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