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Substance Name: 2-(Hexadecyloxy)-5-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)benzenesulphonic acid
RN: 38407-79-3
InChIKey: DTIQUXHSHTXVAX-UHFFFAOYSA-N

Molecular Formula

  • C31-H44-N4-O5-S2

Molecular Weight

  • 616.8436
 
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Names and Synonyms

Synonym

  • EINECS 253-914-9

Systematic Name

  • 2-(Hexadecyloxy)-5-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)benzenesulphonic acid

Registry Numbers

CAS Registry Number

  • 38407-79-3

System Generated Number

  • 0038407793

Structure Descriptors

InChI

1S/C31H44N4O5S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-40-29-22-21-26(24-30(29)42(37,38)39)28(36)25-41-31-32-33-34-35(31)27-19-16-15-17-20-27/h15-17,19-22,24H,2-14,18,23,25H2,1H3,(H,37,38,39)

InChIKey

DTIQUXHSHTXVAX-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCOc1ccc(cc1S(=O)(=O)O)C(=O)CSc2nnnn2c3ccccc3