Vitas-M small molecule compound
dimethyl 2-[1-(2-ethylbutanoyl)-6-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK009814
SMILES CCC(C(=O)N1c2ccc(cc2/C(=C\2/SC(=C(S2)C(=O)OC)C(=O)OC)/C(=S)C1(C)C)OC)CC
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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/c1-8-13(9-2)21(27)26-16-11-10-14(30-5)12-15(16)17(20(33)25(26,3)4)24-34-18(22(28)31-6)19(35-24)23(29)32-7/h10-13H,8-9H2,1-7H3InChIKey
PERRHKGYTMKMJZ-UHFFFAOYSA-NSynonyms
376605-77-5376605775
CCC(C(=O)N1c2ccc(cc2C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=S)C1(C)C)OC)CC
CCC(CC)C(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C
DIMETHYL2(1(2ETHYLBUTANOYL)6METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(2ETHYLBUTANOYL)6METHOXY22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC25H29NO6S3c1813(92)21(27)2616111014(305)1215(16)17(20(33)25(263)4)243418(22(28)316)19(3524)23(29)327h1013H89H217H3
METHYL2(1(2ETHYLBUTANOYL)6METHOXY22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD02127858
STK009814
ZINC000100114850
ZINC100114850
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.