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Substance Name: Barbituric acid, 5-(2-(diethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thio-, hydrate
ID: CQ35005000
InChIKey: ITSOFBSPACLPPZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-N3-O3-S.H2-O

Molecular Weight

  • 381.4943
 
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Names and Synonyms

Synonym

  • 5-(2-(Diethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid hydrate

Systematic Name

  • Barbituric acid, 5-(2-(diethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thio-, hydrate

Registry Numbers

ID Number

  • NIOSH/CQ3500500

System Generated Number

  • CQ35005000

Molecular Formulas

Molecular Formula

  • C18-H25-N3-O3-S.H2-O

Molecular Formula Fragments

  • C18-H25-N3-O3-S
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C18H25N3O3S.H2O/c1-4-20(5-2)12-11-15-16(22)19-18(25)21(17(15)23)13-7-9-14(10-8-13)24-6-3;/h7-10,15H,4-6,11-12H2,1-3H3,(H,19,22,25);1H2

InChIKey

ITSOFBSPACLPPZ-UHFFFAOYSA-N

Smiles

O.CCOc1ccc(cc1)N2C(=S)NC(=O)C(CCN(CC)CC)C2=O