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Substance Name: Butanamide, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)-
RN: 30818-18-9
InChIKey: XBRACQJIEMMORN-UHFFFAOYSA-N

Molecular Formula

  • C40-H50-N8-O3-S

Molecular Weight

  • 722.954
 
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Names and Synonyms

Synonyms

  • 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)butanamide
  • EINECS 250-348-4

Systematic Names

  • 2-(2,4-Bis(tert-pentyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl)phenyl)butyraldehyde
  • Butanamide, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-N-(4-(4,5-dihydro-5-oxo-4-((1-phenyl-1H-tetrazol-5-yl)thio)-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl)phenyl)-

Registry Numbers

CAS Registry Number

  • 30818-18-9

Other Registry Numbers

  • 248915-07-3
  • 93672-51-6

System Generated Number

  • 0030818189

Structure Descriptors

InChI

1S/C40H50N8O3S/c1-8-32(51-33-23-18-27(39(4,5)9-2)26-31(33)40(6,7)10-3)36(49)41-28-19-21-30(22-20-28)47-37(50)34(35(43-47)46-24-14-15-25-46)52-38-42-44-45-48(38)29-16-12-11-13-17-29/h11-13,16-23,26,32,34H,8-10,14-15,24-25H2,1-7H3,(H,41,49)

InChIKey

XBRACQJIEMMORN-UHFFFAOYSA-N

Smiles

C([C@@H](CC)Oc1c(cc(cc1)C(CC)(C)C)C(CC)(C)C)(=O)Nc1ccc(cc1)N1N=C([C@@H](C1=O)Sc1nnnn1c1ccccc1)N1CCCC1