化合物产品

[5-[4-[(4-Tert-butylbenzoyl)carbamothioylamino]anilino]-5-oxopentyl]-dimethylazanium;chloride

CAS 登记号1011301-29-3
[5-[4-[(4-Tert-butylbenzoyl)carbamothioylamino]anilino]-5-oxopentyl]-dimethylazanium;chloride chemical structure
主记录

[5-[4-[(4-Tert-butylbenzoyl)carbamothioylamino]anilino]-5-oxopentyl]-dimethylazanium;chloride

CAS
1011301-29-3
PubChem CID
24772042
SMILES
CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)CCCC[NH+](C)C.[Cl-]
分子式
C25H35ClN4O2S
分子量
491.101
精确分子量
490.2169
InChI
InChI=1S/C25H34N4O2S.ClH/c1-25(2,3)19-11-9-18(10-12-19)23(31)28-24(32)27-21-15-13-20(14-16-21)26-22(30)8-6-7-17-29(4)5;/h9-16H,6-8,17H2,1-5H3,(H,26,30)(H2,27,28,31,32);1H
InChIKey
UBNCTIDXQDCEPI-UHFFFAOYSA-N
LogP
0.3682
TPSA
74.67

名称与别名

  • [5-[4-[(4-Tert-butylbenzoyl)carbamothioylamino]anilino]-5-oxopentyl]-dimethylazanium;chloride
  • 1011301-29-3