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Substance Name: 1H-Tetrazole, 5-(((m-chlorophenyl)thio)methyl)-
RN: 18527-35-0
InChIKey: QXHAUJZTOFQRPP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H7-Cl-N4-S

Molecular Weight

  • 226.69
 
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Names and Synonyms

Synonyms

  • 5-(3-Chlorophenylthiomethyl)tetrazole
  • BL-J 433
  • BRN 1119365

Systematic Name

  • 1H-Tetrazole, 5-(((m-chlorophenyl)thio)methyl)-

Registry Numbers

CAS Registry Number

  • 18527-35-0

System Generated Number

  • 0018527350

Structure Descriptors

InChI

1S/C8H7ClN4S/c9-6-2-1-3-7(4-6)14-5-8-10-12-13-11-8/h1-4H,5H2,(H,10,11,12,13)

InChIKey

QXHAUJZTOFQRPP-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)Cl)SCc1[nH]nnn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2200mg/kg (2200mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 1001, 1969.