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Substance Name: Spiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-4(6H)-one, 3-methyl-2-((phenylmethyl)thio)-
RN: 172984-38-2
InChIKey: GJVVEXOLUAEKGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H26-N2-O-S

Molecular Weight

  • 402.5594
 
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Names and Synonyms

Synonyms

  • 2-(Benzylthio)-3-methyl-4-oxo-1,2,3,4,5,6-hexahydrospiro(benzo(h)quinazoline-5,1'-cyclohexane)
  • 3-Methyl-2-((phenylmethyl)thio)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-((phenylmethyl)thio)-

Registry Numbers

CAS Registry Number

  • 172984-38-2

System Generated Number

  • 0172984382

Structure Descriptors

InChI

1S/C25H26N2OS/c1-27-23(28)21-22(26-24(27)29-17-18-10-4-2-5-11-18)20-13-7-6-12-19(20)16-25(21)14-8-3-9-15-25/h2,4-7,10-13H,3,8-9,14-17H2,1H3

InChIKey

GJVVEXOLUAEKGZ-UHFFFAOYSA-N

Smiles

Cn1c(=O)c2c(nc1SCc3ccccc3)-c4ccccc4CC25CCCCC5

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.