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Substance Name: Cloturin
RN: 104789-46-0
UNII: EQT0968QNX
InChIKey: OQBORDVFGPUGDV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H8-Cl-N5-O-S

Molecular Weight

  • 257.7042
 
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Names and Synonyms

Name of Substance

  • Cloturin

Synonyms

  • 6-(N-(2-Chloroethyl)carbamoyl)thio purine
  • CCRIS 7602
  • Cloturin
  • N-(2-Chloroethyl)thiocarbamic acid 6-purinyl ester
  • RTECS FN0924000
  • S-1H-Purin-6-yl (2-chloroethyl)carbamothioate
  • UNII-EQT0968QNX
  • VUFB-15686

Systematic Names

  • Carbamothioic acid, (2-chloroethyl)-, S-1H-purin-6-yl ester
  • Cloturin

Registry Numbers

CAS Registry Number

  • 104789-46-0

FDA UNII

  • EQT0968QNX

System Generated Number

  • 0104789460

Structure Descriptors

InChI

1S/C8H8ClN5OS/c9-1-2-10-8(15)16-7-5-6(12-3-11-5)13-4-14-7/h3-4H,1-2H2,(H,10,15)(H,11,12,13,14)

InChIKey

OQBORDVFGPUGDV-UHFFFAOYSA-N

Smiles

C(NCCCl)(=O)Sc1[nH]cnc2ncnc12

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral > 3gm/kg (3000mg/kg)   Drugs of the Future. Vol. 15, Pg. 337, 1990.