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Substance Name: EINECS 275-044-9
RN: 70942-39-1
InChIKey: LHJWGDNBXPSCKP-UHFFFAOYSA-N

Molecular Formula

  • C36-H43-N7-O4-S

Molecular Weight

  • 669.847
 
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Names and Synonyms

Results Name

  • EINECS 275-044-9

Synonyms

  • 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4-(1-phenyl-1H-tetrazol-5-yl)thio)-3-ethoxy-5-oxo-1H-pyrazol-1-yl)phenyl)acetamide
  • EINECS 275-044-9

Systematic Names

  • 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(3-ethoxy-4-((1-phenyl-1H-tetrazol-5-yl)thio)-4,5-dihidro-5-oxo-1H-pyrazol-1-yl)phenyl)acetamide
  • Acetamide, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-N-(4-(3-ethoxy-4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-1H-pyrazol-1-yl)phenyl)-

Registry Numbers

CAS Registry Number

  • 70942-39-1

Other Registry Number

  • 93672-50-5

System Generated Number

  • 0070942391

Structure Descriptors

InChI

1S/C36H43N7O4S/c1-8-35(4,5)24-16-21-29(28(22-24)36(6,7)9-2)47-23-30(44)37-25-17-19-27(20-18-25)42-33(45)31(32(39-42)46-10-3)48-34-38-40-41-43(34)26-14-12-11-13-15-26/h11-22,31H,8-10,23H2,1-7H3,(H,37,44)

InChIKey

LHJWGDNBXPSCKP-UHFFFAOYSA-N

Smiles

O=C(Nc1ccc(N2N=C(OCC)[C@@H](Sc3nnnn3c3ccccc3)C2=O)cc1)COc1c(cc(cc1)C(CC)(C)C)C(CC)(C)C