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Substance Name: 2-Hexyldecanoic acid (4-(6-tert-butyl-7-chloro-1H-pyrazolo(1,5-b)(1,2,4)triazol-2-yl)phenylcarbamoyl)methylester
RN: 379268-96-9
InChIKey: YSMXWRVHMQSPJL-UHFFFAOYSA-N

Molecular Weight

  • 586.2162
 
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Names and Synonyms

Synonym

  • EC 448-260-8

Systematic Name

  • 2-Hexyldecanoic acid (4-(6-tert-butyl-7-chloro-1H-pyrazolo(1,5-b)(1,2,4)triazol-2-yl)phenylcarbamoyl)methylester

Registry Numbers

CAS Registry Number

  • 379268-96-9

System Generated Number

  • 0379268969

Structure Descriptors

InChI

1S/C32H48ClN5O3/c1-6-8-10-12-13-15-17-24(16-14-11-9-7-2)31(40)41-22-26(39)34-25-20-18-23(19-21-25)29-35-30-27(33)28(32(3,4)5)36-38(30)37-29/h18-21,24H,6-17,22H2,1-5H3,(H,34,39)(H,35,37)

InChIKey

YSMXWRVHMQSPJL-UHFFFAOYSA-N

Smiles

CCCCCCCCC(CCCCCC)C(=O)OCC(=O)Nc1ccc(cc1)c2nn3nc(c(Cl)c3[nH]2)C(C)(C)C