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Substance Name: Tirilazad mesylate
RN: 110101-67-2
UNII: 19B418DV39
InChIKey: HPZOOQSXPMEJBV-ODCFVKFUSA-N

Note

  • A lazaroid; potent inhibitor of iron-dependent lipid peroxidation; has shown excellent activity in in vivo models of experimental central nervous system trauma & ischemia; tradename Freedox.

Molecular Formula

  • C38-H52-N6-O2.C-H4-O3-S

Molecular Weight

  • 720.974
 

Classification Codes

  • Antioxidants
  • Central Nervous System Agents
  • Neuroprotective Agents
  • Protective Agents
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Names and Synonyms

Results Name

  • Tirilazad mesylate

Name of Substance

  • Tirilazad

Synonyms

  • 21-(4-(2,6-di-1-Pyrrolidinyl-4-pyrimidinyl)-1-piperazinyl)-16-methylpregna-1,4,9(11)-triene-3,20-dione monomethanesulfonate
  • Freedox
  • Tirilazad mesylate
  • U 74006F
  • U-74006F
  • U74006F
  • UNII-19B418DV39

Systematic Name

  • Pregna-1,4,9(11)-triene-3,20-dione, 21-(4-(2,6-di-1-pyrrolidinyl-4-pyrimidinyl)-1-piperazinyl)-16-methyl-, (16alpha)-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 110101-67-2

FDA UNII

  • 19B418DV39

Related Registry Number

  • 111793-42-1 (mesylate:hydrate)

System Generated Number

  • 0110101672

Molecular Formulas

Molecular Formula

  • C38-H52-N6-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C38-H52-N6-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C38H52N6O2.CH4O3S/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44;1-5(2,3)4/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3;1H3,(H,2,3,4)/t26-,29-,31+,35-,37+,38+;/m1./s1

InChIKey

HPZOOQSXPMEJBV-ODCFVKFUSA-N

Smiles

C1CCCN1c1nc(cc(N2CCN(CC([C@H]3[C@@H](C[C@@H]4[C@]3(C)CC=C3[C@@]5(C)C=CC(=O)C=C5CC[C@@H]43)C)=O)CC2)n1)N1CCCC1.OS(=O)(=O)C