4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one结构式

4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one
英文名称:4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one
CAS No.:880447-06-3
分子式:C17H13BrN4O 分子量:369.215322256088
4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one 数据
Mol:
 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5052    1.7672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5233    0.3659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.6848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.3152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3142    2.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3323    0.9537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2278    1.9482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 23  1  0
  2  9  1  0
  3  7  1  0
  3 10  1  0
  3 12  1  0
  4 11  1  0
  4 13  1  0
  5 11  2  0
  5 14  1  0
  6 10  2  0
  7  9  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 12 15  2  0
 12 16  1  0
 13 14  2  0
 13 17  1  0
 14 18  1  0
 15 19  1  0
 16 20  2  0
 17 21  2  0
 18 22  2  0
 19 23  2  0
 20 23  1  0
 21 22  1  0
M  END                                
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4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one Smile 编码:
BrC1C=CC(=CC=1)N1C(C(C2=NC3C=CC=CC=3N2)=C(C1)O)=N
4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one InChi 编码:
1S/C17H13BrN4O/c18-10-5-7-11(8-6-10)22-9-14(23)15(16(22)19)17-20-12-3-1-2-4-13(12)21-17/h1-8,19,23H,9H2,(H,20,21)
4-(1H-1,3-benzodiazol-2-yl)-1-(4-bromophenyl)-5-iminopyrrolidin-3-one InChiKey 编码:
OSBCODBAAUZSRT-UHFFFAOYSA-N