Vitas-M small molecule compound
dimethyl 2-(1-butanoyl-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK057881
SMILES CCCC(=O)N1c2ccccc2/C(=C\2/SC(=C(S2)C(=O)OC)C(=O)OC)/C(=S)C1(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 C22H23NO5S3 MW 477.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5S3/c1-6-9-14(24)23-13-11-8-7-10-12(13)15(18(29)22(23,2)3)21-30-16(19(25)27-4)17(31-21)20(26)28-5/h7-8,10-11H,6,9H2,1-5H3InChIKey
PDPVGDTWQNZKME-UHFFFAOYSA-NSynonyms
296244-32-12(1BUTYRYL22DIMETHYL3THIOXO23DIHYDRO1HQUINOLIN4YLIDENE)(13)DITHIOLE45DICARBOXYLICACIDDIMETHYLESTER
2(1BUTYRYL22DIMETHYL3THIOXO4QUINOLYLIDENE)13DITHIOLE45DICARBOXYLICACIDDIMETHYLESTER
2(22DIMETHYL1(1OXOBUTYL)3SULFANYLIDENE4QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLICACIDDIMETHYLESTER
296244321
CCCC(=O)N1C2=CC=CC=C2C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C
CCCC(=O)N1c2ccccc2C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=S)C1(C)C
DIMETHYL2(1BUTANOYL22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1BUTANOYL22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1butyryl22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC22H23NO5S3c16914(24)231311871012(13)15(18(29)22(232)3)213016(19(25)274)17(3121)20(26)285h781011H69H215H3
MFCD01563718
STK057881
ZINC000006471553
ZINC06471553
ZINC6471553
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