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Substance Name: Acetic acid, ((4,6-dihydro-3-methyl-4-oxospiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-2-yl)thio)-, ethyl ester
RN: 172984-39-3
InChIKey: FQPHJCQYZPVDGH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N2-O3-S

Molecular Weight

  • 398.5244
 
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Names and Synonyms

  • Acetic acid, ((4,6-dihydro-3-methyl-4-oxospiro(benzo(h)quinazoline-5(3H),1'-cyclohexan)-2-yl)thio)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 172984-39-3

System Generated Number

  • 0172984393

Structure Descriptors

InChI

1S/C22H26N2O3S/c1-3-27-17(25)14-28-21-23-19-16-10-6-5-9-15(16)13-22(11-7-4-8-12-22)18(19)20(26)24(21)2/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3

InChIKey

FQPHJCQYZPVDGH-UHFFFAOYSA-N

Smiles

CCOC(=O)CSc1nc-2c(c(=O)n1C)C3(CCCCC3)Cc4c2cccc4

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.