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Substance Name: 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-4-(1,1'-biphenyl)-4-yl-
RN: 135521-73-2
InChIKey: FJGAFPNIACWWIP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H18-N2-O-S

Molecular Weight

  • 451.5677
 
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Names and Synonyms

Synonyms

  • 2-Amino-4-(1,1'-biphenyl)-4-yl-4H,5H-(1)benzothiopyrano(4,3-b)pyran-3-carbonitrile
  • BRN 4273295

Systematic Name

  • 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-4-(1,1'-biphenyl)-4-yl-

Registry Numbers

CAS Registry Number

  • 135521-73-2

System Generated Number

  • 0135521732

Structure Descriptors

InChI

1S/C28H23N2O2S/c29-17-24-27(23-13-11-22(12-14-23)21-9-5-2-6-10-21)25-18-31-16-15-26(25)32(28(24)30)33-19-20-7-3-1-4-8-20/h1-16,27H,18-19,30H2

InChIKey

FJGAFPNIACWWIP-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CSO2C3=C(COC=C3)C(C(=C2N)C#N)c4ccc(cc4)c5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 252mg/kg (252mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 221, 1991.