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Substance Name: Thiocaine
RN: 120-49-0
InChIKey: KGFZGOVGODRJEE-UHFFFAOYSA-N

Molecular Formula

  • C13-H20-N2-O-S

Molecular Weight

  • 252.38
 
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Names and Synonyms

Results Name

  • Thiocaine

Synonyms

  • 3-14-00-01169 (Beilstein Handbook Reference)
  • beta-Diethylaminoethyl p-aminothiobenzoate
  • BRN 2114277
  • NSC 30308
  • p-Aminothiobenzoic acid, S-(2-(diethylamino)ethyl) ester
  • Thicaine
  • Thiocain
  • Thiocaine
  • USAF A-9870

Systematic Names

  • Benzenecarbothioic acid, 4-amino-, S-(2-(diethylamino)ethyl) ester (9CI)
  • Benzoic acid, p-aminothio-, S-(2-(diethylamino)ethyl) ester

Registry Numbers

CAS Registry Number

  • 120-49-0

System Generated Number

  • 0000120490

Structure Descriptors

InChI

1S/C13H20N2OS/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3

InChIKey

KGFZGOVGODRJEE-UHFFFAOYSA-N

Smiles

c1(C(SCCN(CC)CC)=O)ccc(N)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   National Technical Information Service. Vol. AD277-689,