5'-Acetyl-4-{[(2,4-Dimethylphenyl)Sulfonyl]Amino}-2,2'-Bithiophene-5-Carboxylic Acid

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Properties Simple | Detailed

Formula C19H17NO5S3
IUPAC Name 5-(5-acetyl-2-thienyl)-3-[(2,4-dimethylphenyl)sulfonylamino]thiophene-2-carboxylic acid
Molecular Mass 435.537 g·mol−1
Heat of Formation -664.7 ± 16.7 kJ·mol−1
Dipole Moment 5.70 ± 1.08 D
Volume 476.29 Å 3
Surface Area 377.35 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -2.01 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(2,4-dimethylphenyl)sulfonylamino]-5-(5-ethanoylthiophen-2-yl)thiophene-2-carboxylic acid
  • 5-(5-acetyl-2-thienyl)-3-[(2,4-dimethylphenyl)sulfonylamino]-2-thenoic acid
  • 5-(5-acetyl-2-thienyl)-3-[(2,4-dimethylphenyl)sulfonylamino]-2-thiophenecarboxylic acid
  • 5-(5-acetylthiophen-2-yl)-3-[(2,4-dimethylphenyl)sulfonylamino]thiophene-2-carboxylic acid
  • [2,2'-bithiophene]-5-carboxylic acid, 5'-acetyl-4-[[(2,4-dimethylphenyl)sulfonyl]amino]-
  • snh
InChIKey CMHHNHDPPWDNAH-UHFFFAOYSA-N
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