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Substance Name: Benzothieno(2,3-d)pyrimidin-4(1H)-one, 5,6,7,8-tetrahydro-2-(3-(trifluoromethyl)phenyl)-
RN: 120354-29-2
InChIKey: PQECOCLDYWHRFY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H13-F3-N2-O-S

Molecular Weight

  • 350.3627
 
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Names and Synonyms

Synonyms

  • 5,6,7,8-Tetrahydro-2-(3-(trifluoromethyl)phenyl)benzothieno(2,3-d)pyrimidin-4(1H)-one
  • BRN 5995883

Systematic Name

  • Benzothieno(2,3-d)pyrimidin-4(1H)-one, 5,6,7,8-tetrahydro-2-(3-(trifluoromethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 120354-29-2

System Generated Number

  • 0120354292

Structure Descriptors

InChI

1S/C17H13F3N2OS/c18-17(19,20)10-5-3-4-9(8-10)14-21-15(23)13-11-6-1-2-7-12(11)24-16(13)22-14/h3-5,8H,1-2,6-7H2,(H,21,22,23)

InChIKey

PQECOCLDYWHRFY-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)C(F)(F)F)c2[nH]c3c(c4c(s3)CCCC4)c(=O)n2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 453, 1988.