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Substance Name: 3H,5H-Imidazo(1,2-c)thiazolium, 1,1'-(methanetetraylbis(nitrilo(3,5-dimethyl-4,1-phenylene)methylene))bis(2,7-dihydro-2-phenyl-, dibromide
RN: 128811-88-1
InChIKey: DFXFABXKNGSVQN-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H44-N6-S2.2Br

Molecular Weight

  • 844.7806
 
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Names and Synonyms

  • 3H,5H-Imidazo(1,2-c)thiazolium, 1,1'-(methanetetraylbis(nitrilo(3,5-dimethyl-4,1-phenylene)methylene))bis(2,7-dihydro-2-phenyl-, dibromide

Registry Numbers

CAS Registry Number

  • 128811-88-1

System Generated Number

  • 0128811881

Molecular Formulas

Molecular Formula

  • C41-H44-N6-S2.2Br

Molecular Formula Fragments

  • Br
  • C41-H44-N6-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C41H44N6S2.2BrH/c1-28-19-32(23-46-36(34-11-7-5-8-12-34)25-44-15-17-48-40(44)46)20-29(2)38(28)42-27-43-39-30(3)21-33(22-31(39)4)24-47-37(35-13-9-6-10-14-35)26-45-16-18-49-41(45)47;;/h5-14,19-22,36-37H,15-18,23-26H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

DFXFABXKNGSVQN-UHFFFAOYSA-L

Smiles

Cc1cc(cc(c1N=C=Nc2c(cc(cc2C)C[N+]3=C4N(CCS4)CC3c5ccccc5)C)C)C[N+]6=C7N(CCS7)CC6c8ccccc8.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 1500ug/kg (1.5mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 24(4), Pg. 42, 1990.