Vitas-M small molecule compound
diethyl 2-[6-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK057484
SMILES CCOc1ccc2c(c1)/C(=C\1/SC(=C(S1)C(=O)OCC)C(=O)OCC)/C(=S)C(N2C(=O)C(F)(F)F)(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 C24H24F3NO6S3 MW 575.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24F3NO6S3/c1-6-32-12-9-10-14-13(11-12)15(18(35)23(4,5)28(14)22(31)24(25,26)27)21-36-16(19(29)33-7-2)17(37-21)20(30)34-8-3/h9-11H,6-8H2,1-5H3InChIKey
MPFAQTXTZGZTMP-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OCC)C(=O)OCC)(C)C)C(=O)C(F)(F)F
CCOc1ccc2c(c1)C(=C1SC(=C(S1)C(=O)OCC)C(=O)OCC)C(=S)C(N2C(=O)C(F)(F)F)(C)C
DIETHYL2(6ETHOXY22DIMETHYL3SULFANYLIDENE1(222TRIFLUOROACETYL)QUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(6ethoxy22dimethyl3thioxo1(222trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIETHYL2(6ETHOXY22DIMETHYL3THIOXO1(TRIFLUOROACETYL)23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC24H24F3NO6S3c1632129101413(1112)15(18(35)23(45)28(14)22(31)24(2526)27)213616(19(29)3372)17(3721)20(30)3483h911H68H215H3
MFCD01796178
STK057484
ZINC000008431815
ZINC08431815
ZINC8431815
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.