Vitas-M small molecule compound
diethyl 2-(7-ethoxy-2,2-dimethyl-1-propanoyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK039329
SMILES CCOc1ccc2c(c1)N(C(=O)CC)C(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OCC)C(=O)OCC)(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 C25H29NO6S3 MW 535.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6S3/c1-7-17(27)26-16-13-14(30-8-2)11-12-15(16)18(21(33)25(26,5)6)24-34-19(22(28)31-9-3)20(35-24)23(29)32-10-4/h11-13H,7-10H2,1-6H3InChIKey
COPYNAMVRQAGAT-UHFFFAOYSA-NSynonyms
314039-77-5314039775
CCC(=O)N1C2=C(C=CC(=C2)OCC)C(=C3SC(=C(S3)C(=O)OCC)C(=O)OCC)C(=S)C1(C)C
CCOc1ccc2c(c1)N(C(=O)CC)C(C(=S)C2=C1SC(=C(S1)C(=O)OCC)C(=O)OCC)(C)C
DIETHYL2(7ETHOXY22DIMETHYL1PROPANOYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(7ETHOXY22DIMETHYL1PROPANOYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(7ETHOXY22DIMETHYL1PROPIONYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(7ethoxy22dimethyl1propionyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC25H29NO6S3c1717(27)26161314(3082)111215(16)18(21(33)25(265)6)243419(22(28)3193)20(3524)23(29)32104h1113H710H216H3
MFCD01796158
STK039329
ZINC000008431799
ZINC08431799
ZINC8431799
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.