Vitas-M small molecule compound
dimethyl 2-{2,2-dimethyl-6-[(phenylcarbonyl)oxy]-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK015623
SMILES COC(=O)C1=C(S/C(=C\2/c3cc(ccc3NC(C2=S)(C)C)OC(=O)c2ccccc2)/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 C25H21NO6S3 MW 527.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO6S3/c1-25(2)20(33)17(24-34-18(22(28)30-3)19(35-24)23(29)31-4)15-12-14(10-11-16(15)26-25)32-21(27)13-8-6-5-7-9-13/h5-12,26H,1-4H3InChIKey
KHLJXNBSAMXJKR-UHFFFAOYSA-NSynonyms
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1)C=CC(=C3)OC(=O)C4=CC=CC=C4)CCOC(=O)C1=C(SC(=C2c3cc(ccc3NC(C2=S)(C)C)OC(=O)c2ccccc2)S1)C(=O)OC
DIMETHYL2(22DIMETHYL6((PHENYLCARBONYL)OXY)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(6(benzoyloxy)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(6BENZOYLOXY22DIMETHYL3SULFANYLIDENE1HQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
Registry IDs
MFCD02240206ZINC000097950505
ZINC97950505
Check stock
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