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Substance Name: 2-Naphthalenecarboxamide, N-(4-(2,4-bis(1,1-dimethylpropyl)phenoxy)butyl)-1-hydroxy-4-((1-phenyl-1H-tetrazol-5-yl)thio)-
RN: 5084-12-8
InChIKey: CFRUNFQXALDGBM-UHFFFAOYSA-N

Molecular Formula

  • C38-H45-N5-O3-S

Molecular Weight

  • 651.872
 
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Names and Synonyms

Synonym

  • EINECS 225-796-9

Systematic Names

  • 2-Naphthalenecarboxamide, N-(4-(2,4-bis(1,1-dimethylpropyl)phenoxy)butyl)-1-hydroxy-4-((1-phenyl-1H-tetrazol-5-yl)thio)-
  • N-(4-(2,4-Bis(1,1-dimethylpropyl)phenoxy)butyl)-1-hydroxy-4-((1-phenyl-1H-tetrazol-5-yl)thio)naphthalene-2-carboxamide

Registry Numbers

CAS Registry Number

  • 5084-12-8

System Generated Number

  • 0005084128

Structure Descriptors

InChI

1S/C38H45N5O3S/c1-7-37(3,4)26-20-21-32(31(24-26)38(5,6)8-2)46-23-15-14-22-39-35(45)30-25-33(28-18-12-13-19-29(28)34(30)44)47-36-40-41-42-43(36)27-16-10-9-11-17-27/h9-13,16-21,24-25,44H,7-8,14-15,22-23H2,1-6H3,(H,39,45)

InChIKey

CFRUNFQXALDGBM-UHFFFAOYSA-N

Smiles

O=C(NCCCCOc1c(cc(cc1)C(CC)(C)C)C(CC)(C)C)c1c(O)c2c(c(Sc3nnnn3c3ccccc3)c1)cccc2