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Substance Name: Acetic acid, ((6-(4-nitrophenoxy)-4-pyrimidinyl)thio)-, ethyl ester
RN: 124066-45-1
InChIKey: ULDSULJNVTWECZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H13-N3-O5-S

Molecular Weight

  • 335.3387
 
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Names and Synonyms

Synonyms

  • BRN 3629614
  • Ethyl ((6-(4-nitrophenoxy)-4-pyrimidinyl)thio)acetate

Systematic Name

  • Acetic acid, ((6-(4-nitrophenoxy)-4-pyrimidinyl)thio)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 124066-45-1

System Generated Number

  • 0124066451

Structure Descriptors

InChI

1S/C14H13N3O5S/c1-2-21-14(18)8-23-13-7-12(15-9-16-13)22-11-5-3-10(4-6-11)17(19)20/h3-7,9H,2,8H2,1H3

InChIKey

ULDSULJNVTWECZ-UHFFFAOYSA-N

Smiles

CCOC(=O)CSc1cc(ncn1)Oc2ccc(cc2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 500, 1989.