当前位置: 首页 » 资料 » 化学物质数据库 » 2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide,Canonical SMILE

2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide,Canonical SMILE

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:0
摘 要: 2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide,Canonical SMILES: CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3,InChI: InChI=1/C19H17N3O3S/c1-14-6-2-3-7-17(14)19(23)21-15-9-11-16(12-10-15)26,(24,25)22-18-8-4-5-13-20-18/h2-13H,1H3,(H,20,
[Synonyms]

[Structure]
 2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide,Canonical SMILE

[ Properties Computed from Structure]
Molecular Weight367.42158 [g/mol]
Molecular FormulaC19H17N3O3S
XLogP3.6
H-Bond Donor2
H-Bond Acceptor5
Rotatable Bond Count5
Tautomer Count4
Exact Mass367.099062
MonoIsotopic Mass367.099062
Topological Polar Surface Area88.2
Heavy Atom Count26
Formal Charge0
Complexity567
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
Canonical SMILES: CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3
InChI: InChI=1/C19H17N3O3S/c1-14-6-2-3-7-17(14)19(23)21-15-9-11-16(12-10-15)26
(24,25)22-18-8-4-5-13-20-18/h2-13H,1H3,(H,20,22)(H,21,23)/f/h21-22H

 
本文导航:
  • (1) 2-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide,Canonical SMILE
  • 下一篇:鳖甲
  • 上一篇:暂无
 
[ 资料搜索 ]  [ 加入收藏 ]  [ 告诉好友 ]  [ 打印本文 ]  [ 关闭窗口 ]

 

 
推荐图文
推荐资料
热门关注