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Substance Name: Glycine, N-(vanillylthiocarbamoyl)-, butyl ester
RN: 101516-99-8
InChIKey: COVOCBUNANFHCK-UHFFFAOYSA-N

Molecular Formula

  • C15-H22-N2-O4-S

Molecular Weight

  • 326.4148
 
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Names and Synonyms

Synonyms

  • 1-Carbobutoxymethyl-3-vanillyl-2-thiourea
  • N-(Vanillylthiocarbamoyl)glycine butyl ester

Systematic Name

  • Glycine, N-(vanillylthiocarbamoyl)-, butyl ester

Registry Numbers

CAS Registry Number

  • 101516-99-8

System Generated Number

  • 0101516998

Structure Descriptors

InChI

1S/C15H22N2O4S/c1-3-4-7-21-14(19)10-17-15(22)16-9-11-5-6-12(18)13(8-11)20-2/h5-6,8,18H,3-4,7,9-10H2,1-2H3,(H2,16,17,22)

InChIKey

COVOCBUNANFHCK-UHFFFAOYSA-N

Smiles

CCCCOC(=O)CNC(=S)NCc1ccc(c(c1)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08007,