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Home > Encyclopedia > Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI)

Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI)

Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI) structure

Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI) 

structure
  • CAS No:

    581781-20-6

  • Formula:

    C17H18N2O2S3

  • Chemical Name:

    Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI)

  • Synonyms:

    STK111328;AKOS003263360;MCULE-4681550478;Ethyl 4-({[2-(2-thienyl)-1,3-thiazolidin-3-yl]carbothioyl}amino)benzoate;ethyl 4-({[2-(thiophen-2-yl)-1,3-thiazolidin-3-yl]carbonothioyl}amino)benzoate

Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI) Basic Attributes

378.53202

378.053

Characteristics

127

3.7

1.382±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:378.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:378.05304134
Monoisotopic Mass:378.05304134
Topological Polar Surface Area:127
Heavy Atom Count:24
Complexity:455
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Benzoic acid, 4-[[[2-(2-thienyl)-3-thiazolidinyl]thioxomethyl]amino]-, ethyl ester (9CI)

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