AC1MWJ1J

dimethyl 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-(2,2,2-trifluoroacetyl)quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Also Known As: ChemDiv1_021320|HMS647J02|AJ-292/13095201|dimethyl 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-(2,2,2-trifluoroacetyl)quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate|SR-01000431155-1|4,5-DIMETHYL 2-[7-ETHOXY-2,2-DIMETHYL-3-SULFANYLIDENE-1-(2,2,2-TRIFLUOROACETYL)-1,2,3,4-TETRAHYDROQUINOLIN-4-YLIDENE]-2H-1,3-DITHIOLE-4,5-DICARBOXYLATE|dimethyl 2-(7-ethoxy-2,2-dimethyl-3-thioxo-1-(2,2,2-trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate|dimethyl 2-(7-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate|dimethyl 2-[7-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate|methyl 2-[7-ethoxy-2,2-dimethyl-3-thioxo-1-(2,2,2-trifluoroacetyl)(4-1,2-dihyd roquinolylidene)]-5-(methoxycarbonyl)-1,3-dithiolene-4-carboxylate

Molecular Formula	C22H20F3NO6S3
Molecular Weight	547.04047 g/mol
LogP	4.8489
Topological Polar Surface Area	82.14 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	4
Exact Mass	547.04047
Monoisotopic Mass	547.04047
Heavy Atoms	35
Complexity	1159.3666

Chemical Identifiers

CAS Number	314039-75-3
SMILES	CCOC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)C(F)(F)F)(C)C