Vitas-M small molecule compound
diethyl 2-[6-methoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK789697
SMILES CCOC(=O)C1=C(S/C(=C\2/c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)C(F)(F)F)/S1)C(=O)OCC
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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 C23H22F3NO6S3 MW 561.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22F3NO6S3/c1-6-32-18(28)15-16(19(29)33-7-2)36-20(35-15)14-12-10-11(31-5)8-9-13(12)27(21(30)23(24,25)26)22(3,4)17(14)34/h8-10H,6-7H2,1-5H3InChIKey
CUZBDSJIJZTHPE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)OC)N(C(C2=S)(C)C)C(=O)C(F)(F)F)S1)C(=O)OCC
CCOC(=O)C1=C(SC(=C2c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)C(F)(F)F)S1)C(=O)OCC
DIETHYL2(6METHOXY22DIMETHYL3SULFANYLIDENE1(222TRIFLUOROACETYL)QUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(6methoxy22dimethyl3thioxo1(222trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIETHYL2(6METHOXY22DIMETHYL3THIOXO1(TRIFLUOROACETYL)23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(6methoxy22dimethyl3thioxo1(trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC23H22F3NO6S3c163218(28)1516(19(29)3372)3620(3515)14121011(315)8913(12)27(21(30)23(2425)26)22(34)17(14)34h810H67H215H3
MFCD01796174
ZINC000008431759
ZINC08431759
ZINC8431759
Check stock
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Check stock on Vitas-MAvailable files
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