3684-0181结构式

3684-0181
英文名称:3684-0181
CAS No.:420832-74-2
分子式:C19H18N3O2FS 分子量:371.429
3684-0181 数据
Mol:
73    4.7100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2577    2.3550    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6173    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8980    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8980    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5384    2.3550    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1787    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5384    3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1787    4.7100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  2  2  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  8  1  0  0  0  0
 13 14  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 16  1  0  0  0  0
 25 26  2  0  0  0  0
M  END                                
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3684-0181 Smile 编码:
FC1=CC=C(N2C(C)=CC(/C=C3\C(=O)N(C)C(=S)N(C)C\3=O)=C2C)C=C1