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Dataset #239

[NH2:10][C:11]1[C:16]([S:7][C:1]2[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=2)=[N:15][C:14]([C:18]2[CH:23]=[CH:22][C:21]([O:24][CH3:25])=[CH:20][CH:19]=2)=[CH:13][N:12]=1
Reaction #1121775
Yield 70.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:10][C:11]1[C:16]([S:7][C:1]2[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=2)=[N:15][C:14]([C:18]2[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=2)=[CH:13][N:12]=1
Reaction #1121776
Yield 79.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:9][C:10]1[C:15]([S:6][CH:1]2[CH2:5][CH2:4][CH2:3][CH2:2]2)=[N:14][C:13]([C:17]2[CH:22]=[CH:21][CH:20]=[CH:19][CH:18]=2)=[CH:12][N:11]=1
Reaction #1121777
Yield 67.6%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:14][C:15]1[C:20]([S:11][C:1]23[CH2:8][CH:7]4[CH2:6][CH:5]([CH2:4][CH:3]([CH2:9]4)[CH2:2]2)[CH2:10]3)=[N:19][C:18]([C:22]2[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=2)=[CH:17][N:16]=1
Reaction #1121778
Yield 62.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:13][C:14]1[C:19]([S:1][C:2]2[S:3][C:4]3[CH:10]=[CH:9][CH:8]=[CH:7][C:5]=3[N:6]=2)=[N:18][C:17]([C:21]2[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=2)=[CH:16][N:15]=1
Reaction #1121779
Yield 23.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:10][C:11]1[C:16]([O:7][C:1]2[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=2)=[N:15][C:14]([C:18]2[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=2)=[CH:13][N:12]=1
Reaction #1121780
Yield 62.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:33]([O:32][C:31]1[N:11]2[CH:12]=[C:13]([C:25]3[CH:26]=[CH:27][CH:28]=[CH:29][CH:30]=3)[N:14]=[C:15]([S:16][C:17]3[CH:22]=[CH:21][C:20]([O:23][CH3:24])=[CH:19][CH:18]=3)[C:10]2=[N:9][C:8]=1[CH2:1][C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1)(=[O:35])[CH3:34]
Reaction #1121781
Yield 66.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH:6]1[CH:1]=[CH:2][C:3]([C:27]([OH:28])=[O:26])=[C:4]([C:10]2[C:11]3[CH:12]=[CH:13][C:14]([OH:25])=[CH:15][C:16]=3[O:17][C:18]3[C:19]=2[CH:20]=[CH:21][C:22]([CH:23]=3)=[O:24])[CH:5]=1
Reaction #1121782
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:9]([O:10][C:12]1[N:20]=[CH:19][N:18]=[C:17]2[C:13]=1[NH:14][CH:15]=[N:16]2)[C:6]1[CH:7]=[CH:8][CH:3]=[CH:4][CH:5]=1
Reaction #1121783
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:24][O:25][C:26](=[O:29])[CH2:27][N:13]1[CH:12]=[N:11][C:10]2[C:14]1=[N:15][CH:16]=[N:17][C:9]=2[O:8][CH2:1][C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
Reaction #1121784
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:15]([O:14][C:10]1[N:9]=[CH:8][N:7]=[C:6]2[C:11]=1[N:12]=[CH:13][N:5]2[CH2:4][C:3]([OH:22])=[O:2])[C:16]1[CH:17]=[CH:18][CH:19]=[CH:20][CH:21]=1
Reaction #1121785
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[CH:3]=[C:4]([C:8](=[O:13])[CH2:9][CH2:10][CH:11]=[O:12])[CH:5]=[N:6][CH:7]=1
Reaction #1121786
Yield 124.9%DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[CH:10]=[CH:9][C:5]([C:6]([N:38]([O:37][CH3:33])[CH3:39])=[O:7])=[CH:4][CH:3]=1
Reaction #1121787
Yield 79.0%DOI: 10.6084/m9.figshare.5104873.v1
[F:28][C:29]1[CH:40]=[CH:39][C:32]([C:33]([C:2]2[CH:3]=[N:4][CH:5]=[C:6]([C@@H:8]3[CH2:12][CH2:11][CH2:10][N:9]3[C@@H:13]([C:15]3[CH:20]=[CH:19][C:18]([O:21][CH3:22])=[CH:17][CH:16]=3)[CH3:14])[CH:7]=2)=[O:34])=[CH:31][CH:30]=1
Reaction #1121788
Yield 95.3%DOI: 10.6084/m9.figshare.5104873.v1
[NH:17]1[CH2:18][CH2:19][CH2:20][C@H:16]1[C:14]1[CH:15]=[C:10]([CH:8]=[O:9])[CH:11]=[N:12][CH:13]=1
Reaction #1121789
Yield 109.1%DOI: 10.6084/m9.figshare.5104873.v1
[C:14]([O:18][C:19](=[O:20])[NH:21][CH3:22])([CH3:17])([CH3:16])[CH3:15]
Reaction #1121790
Yield 363.0%DOI: 10.6084/m9.figshare.5104873.v1
[F:23][C:24]1[CH:29]=[CH:28][C:27]([O:30][C:2]2[CH:3]=[N:4][CH:5]=[C:6]([C@@H:8]3[CH2:12][CH2:11][CH2:10][N:9]3[C@@H:13]([C:15]3[CH:20]=[CH:19][C:18]([O:21][CH3:22])=[CH:17][CH:16]=3)[CH3:14])[CH:7]=2)=[CH:26][CH:25]=1
Reaction #1121791
Yield 91.1%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:18][O:19][N:13]([CH3:16])[C:8]([C:4]1[CH:3]=[C:2]([Br:1])[CH:7]=[CH:6][N:5]=1)=[O:10]
Reaction #1121792
Yield 86.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:12][C:10]1[CH:9]=[CH:8][N:7]=[C:6]([C:4](=[O:5])[CH2:18][CH2:17][CH:16]([O:20][CH3:21])[O:15][CH3:14])[CH:11]=1
Reaction #1121793
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[CH:7]=[CH:6][N:5]=[C:4]([C:8](=[O:16])[CH2:9][CH2:10][CH:11]=[O:12])[CH:3]=1
Reaction #1121794
DOI: 10.6084/m9.figshare.5104873.v1
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