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Substance Name: Alanine, 3-thiocarbamoyl-, L-
RN: 2072-71-1
InChIKey: XIQSDJATPSOWKM-REOHCLBHSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C4-H8-N2-O3-S

Molecular Weight

  • 164.184
 
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Names and Synonyms

Synonyms

  • 3-Carbamylthioalanine
  • 3-Thiocarbamoyl-L-alanine
  • 4-04-00-03150 (Beilstein Handbook Reference)
  • AI3-26321
  • Alanine, 3-thiocarbamoyl-, L-
  • BRN 1707518
  • Cysteine, S-carbamate, monohydrate, L-
  • EINECS 218-195-8
  • L-Cysteine carbamate
  • L-Cysteine, S-carbamate
  • NSC 102498
  • S-Carbamoyl-L-cysteine
  • S-Carbamoylcysteine
  • S-Carbamyl-L-cysteine
  • S-Carbamylcysteine
  • SCC

Systematic Names

  • Alanine, 3-thiocarbamoyl-, L-
  • Cysteine, carbamate (ester), L (8CI)
  • L-Cysteine, S-carbamate (ester)
  • L-Cysteinyl carbamate

Registry Numbers

CAS Registry Number

  • 2072-71-1

System Generated Number

  • 0002072711

Structure Descriptors

InChI

1S/C4H8N2O3S/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1

InChIKey

XIQSDJATPSOWKM-REOHCLBHSA-N

Smiles

C([C@@H](C(O)=O)N)C(NS)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1070mg/kg (1070mg/kg)   "Progress in Chemotherapy, Proceedings of the 8th International Congress on Chemotherapy, Athens, Greece, 1973," Daikos, G.K. ed., Athens, Greece, Hellenic Soc. for Chemotherapy, 1974Vol. 3, Pg. 771, 1974.
rat LD50 intraperitoneal 925mg/kg (925mg/kg)   "Progress in Chemotherapy, Proceedings of the 8th International Congress on Chemotherapy, Athens, Greece, 1973," Daikos, G.K. ed., Athens, Greece, Hellenic Soc. for Chemotherapy, 1974Vol. 3, Pg. 771, 1974.