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Substance Name: 4H-Pyrido(4',3':4,5)thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine-9(8H)-carboxamide, 7,10-dihydro-6-(2-chlorophenyl)-N-(2,4-difluorophenyl)-1-methyl-
RN: 132418-58-7
InChIKey: SGKVJXJMQRXLDK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H19-Cl-F2-N6-O-S

Molecular Weight

  • 524.9811
 
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Names and Synonyms

  • 4H-Pyrido(4',3':4,5)thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine-9(8H)-carboxamide, 7,10-dihydro-6-(2-chlorophenyl)-N-(2,4-difluorophenyl)-1-methyl-

Registry Numbers

CAS Registry Number

  • 132418-58-7

System Generated Number

  • 0132418587

Structure Descriptors

InChI

1S/C25H19ClF2N6OS/c1-13-31-32-21-11-29-23(15-4-2-3-5-17(15)26)22-16-8-9-33(12-20(16)36-24(22)34(13)21)25(35)30-19-7-6-14(27)10-18(19)28/h2-7,10H,8-9,11-12H2,1H3,(H,30,35)

InChIKey

SGKVJXJMQRXLDK-UHFFFAOYSA-N

Smiles

Cc1nnc2n1-c3c(c4c(s3)CN(CC4)C(=O)Nc5ccc(cc5F)F)C(=NC2)c6ccccc6Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5492906,
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5492906,