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Substance Name: 1H-Pyrazole, 1-acetyl-5-(2-fluorophenyl)-4,5-dihydro-3-(2-(5-methyl-2-(2-(4-methylphenyl)-1H-indol-3-yl)-4-oxo-3-thiazolidinyl)phenyl)-
RN: 133405-43-3
InChIKey: FGOCDDKZJQXBEM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H31-F-N4-O2-S

Molecular Weight

  • 602.7309
 
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Names and Synonyms

  • 1H-Pyrazole, 1-acetyl-5-(2-fluorophenyl)-4,5-dihydro-3-(2-(5-methyl-2-(2-(4-methylphenyl)-1H-indol-3-yl)-4-oxo-3-thiazolidinyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 133405-43-3

System Generated Number

  • 0133405433

Structure Descriptors

InChI

1S/C36H31FN4O2S/c1-21-16-18-24(19-17-21)34-33(27-12-5-8-14-29(27)38-34)36-40(35(43)22(2)44-36)31-15-9-6-11-26(31)30-20-32(41(39-30)23(3)42)25-10-4-7-13-28(25)37/h4-19,22,32,36,38H,20H2,1-3H3

InChIKey

FGOCDDKZJQXBEM-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2c(c3ccccc3[nH]2)C4N(C(=O)C(S4)C)c5ccccc5C6=NN(C(C6)c7ccccc7F)C(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 100mg/kg (100mg/kg)   Indian Drugs. Vol. 28, Pg. 111, 1990.