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Substance Name: Thiopyrano(2,3-c)pyrrole, octahydro-6-((2-(dimethylamino)phenyl)acetyl)-4,4-diphenyl-, cis-(+-)-
RN: 146674-52-4
InChIKey: HGBDIVUCNBMDBC-VPUSJEBWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H32-N2-O-S

Molecular Weight

  • 504.7158
 
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Names and Synonyms

Synonym

  • ((Dimethylamino-2 phenyl)acetyl)-6 diphenyl-4,4 perhydrothiopyrano(2,3-c)pyrrole-(4aRS,7aRS)

Systematic Name

  • Thiopyrano(2,3-c)pyrrole, octahydro-6-((2-(dimethylamino)phenyl)acetyl)-4,4-diphenyl-, cis-(+-)-

Registry Numbers

CAS Registry Number

  • 146674-52-4

System Generated Number

  • 0146674524

Structure Descriptors

InChI

1S/C29H32N2O2S2/c1-30(2)26-16-10-9-11-22(26)19-28(32)31-20-25-27(21-31)33-18-17-29(25,34-23-12-5-3-6-13-23)35-24-14-7-4-8-15-24/h3-16,25,27H,17-21H2,1-2H3/t25-,27+/m1/s1

InChIKey

HGBDIVUCNBMDBC-VPUSJEBWSA-N

Smiles

CN(C)c1ccccc1CC(=O)N2C[C@@H]3[C@H](C2)OCCC3(Sc4ccccc4)Sc5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 100mg/kg (100mg/kg)   European Patent Application. Vol. #0514275,
mouse LD subcutaneous > 40mg/kg (40mg/kg)   European Patent Application. Vol. #0514275,