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Home > Encyclopedia > ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate

ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate

ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate structure

ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate 

structure
  • CAS No:

    331973-72-9

  • Formula:

    C27H27NO3S3

  • Chemical Name:

    ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate

  • Synonyms:

    ZINC2059468;STK395124;AKOS005433581;ST50913940;AG-690/11838255;331973-72-9;ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate;ethyl 2-(1-butanoyl-2,2-dimethyl-3-thioxo(4-1,2-dihydroquinolylidene))-5-pheny l-1,3-dithiolene-4-carboxylate;ethyl 2-(1-butanoyl-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate;ethyl 2-(1-butyryl-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate

ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Basic Attributes

509.7 g/mol

509.11530724 g/mol

Characteristics

129 Ų

Computed Properties

Molecular Weight:509.7
XLogP3:6.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:509.11530724
Monoisotopic Mass:509.11530724
Topological Polar Surface Area:129
Heavy Atom Count:34
Complexity:901
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate

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