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Substance Name: Spiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-4(6H)-one, 3-methyl-2-(2-propenylthio)-
RN: 172984-37-1
InChIKey: VSIMTUYWVZXNNK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N2-O-S

Molecular Weight

  • 352.4996
 
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Names and Synonyms

Synonyms

  • 2-(Allythio)-3-methyl-4-oxo-1,2,3,4,5,6-hexahydrospiro(benzo(h)quinazoline-5,1'-cyclohexane)
  • 3-Methyl-2-(2-propenylthio)spiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-4(6H)-one

Systematic Name

  • Spiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-4(6H)-one, 3-methyl-2-(2-propenylthio)-

Registry Numbers

CAS Registry Number

  • 172984-37-1

System Generated Number

  • 0172984371

Structure Descriptors

InChI

1S/C21H24N2OS/c1-3-13-25-20-22-18-16-10-6-5-9-15(16)14-21(11-7-4-8-12-21)17(18)19(24)23(20)2/h3,5-6,9-10H,1,4,7-8,11-14H2,2H3

InChIKey

VSIMTUYWVZXNNK-UHFFFAOYSA-N

Smiles

Cn1c(=O)c2c(nc1SCC=C)-c3ccccc3CC24CCCCC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 4gm/kg (4000mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 259, 1995.