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Substance Name: 1,3-Diethyl-2-thiobarbituric acid
RN: 5217-47-0
UNII: BXB40M6A7W
InChIKey: SHBTUGJAKBRBBJ-UHFFFAOYSA-N

Note

  • Used in urinary test for smoking.

Molecular Formula

  • C8-H12-N2-O2-S

Molecular Weight

  • 200.2608
 
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Names and Synonyms

Name of Substance

  • 1,3-Diethyl-2-thiobarbituric acid

Synonyms

  • 1,3-Diethyl-2-thiobarbituric acid
  • 1,3-Diethylthiobarbituric acid
  • 4,6(1H,5H)-Pyrimidinedione, 1,3-diethyldihydro-2-thioxo-
  • EINECS 226-010-7
  • N,N'-Diethyl-2-thiobarbituric acid
  • N,N'-Diethylthiobarbituric acid
  • NSC 158284
  • UNII-BXB40M6A7W

Systematic Names

  • 1,3-Diethyldihydro-2-thioxopyrimidine-4,6(1H,5H)-dione
  • 4,6(1H,5H)-Pyrimidinedione, 1,3-diethyldihydro-2-thioxo-
  • Barbituric acid, 1,3-diethyl-2-thio- (8CI)

Registry Numbers

CAS Registry Number

  • 5217-47-0

FDA UNII

  • BXB40M6A7W

Other Registry Numbers

  • 1190104-61-0
  • 61732-60-3

System Generated Number

  • 0005217470

Structure Descriptors

InChI

1S/C8H12N2O2S/c1-3-9-6(11)5-7(12)10(4-2)8(9)13/h3-5H2,1-2H3

InChIKey

SHBTUGJAKBRBBJ-UHFFFAOYSA-N

Smiles

CCN1C(=O)CC(=O)N(C1=S)CC