Vitas-M small molecule compound
dimethyl 2-(2,2,6,8-tetramethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK789401
SMILES COC(=O)C1=C(S/C(=C\2/c3cc(C)cc(c3NC(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/c1-9-7-10(2)13-11(8-9)12(16(26)20(3,4)21-13)19-27-14(17(22)24-5)15(28-19)18(23)25-6/h7-8,21H,1-6H3InChIKey
IQMAKIHVZSMXBZ-UHFFFAOYSA-NSynonyms
330180-79-5330180795
CC1=CC(=C2C(=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2)(C)C)C
COC(=O)C1=C(SC(=C2c3cc(C)cc(c3NC(C2=S)(C)C)C)S1)C(=O)OC
dimethyl2(2268tetramethyl3sulfanylidene1Hquinolin4ylidene)13dithiole45dicarboxylate
dimethyl2(2268tetramethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC20H21NO4S3c19710(2)1311(89)12(16(26)20(34)2113)192714(17(22)245)15(2819)18(23)256h7821H16H3
MFCD01156178
ZINC000006177852
ZINC06177852
ZINC6177852
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