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Dataset #505

[Cl:19][CH2:20][CH2:21][C:22]([NH:8][C:7]1[C:3]([Cl:2])=[N:4][NH:5][CH:6]=1)=[O:23]
Reaction #2254147
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:7][C:8]1[C:12]([NH:13][C:14](=[O:24])[CH2:15][CH2:16][S:17][CH2:18][CH2:19][C:20]([F:21])([F:22])[F:23])=[CH:11][N:10]([C:32]2[CH:33]=[N:34][CH:35]=[CH:36][CH:37]=2)[N:9]=1
Reaction #2254148
Yield 53.3%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:7][C:8]1[C:12]([N:13]([CH2:37][CH3:38])[C:14](=[O:24])[CH2:15][CH2:16][S:17][CH2:18][CH2:19][C:20]([F:22])([F:21])[F:23])=[CH:11][N:10]([C:25]2[CH:26]=[N:27][CH:28]=[CH:29][CH:30]=2)[N:9]=1
Reaction #2254149
Yield 66.4%DOI: 10.6084/m9.figshare.5104873.v1
[C:17]([N:1]1[CH:5]=[C:4]([NH:6][C:24](=[O:26])[CH3:25])[CH:3]=[N:2]1)(=[O:19])[CH3:18]
Reaction #2254150
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[S:3][CH:4]=[C:5]([C:7]([NH:14][S:11]([CH3:10])(=[O:13])=[O:12])=[O:9])[N:6]=1
Reaction #2254151
Yield 91.1%DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[CH:3]=[C:4]([C:8]2[S:9][C:10]([C:14]3[CH:15]=[C:16]([C:17]([O:19][CH2:20][CH3:21])=[O:18])[N:25]([CH3:24])[N:26]=3)=[C:11]([CH3:13])[N:12]=2)[CH:5]=[N:6][CH:7]=1
Reaction #2254152
Yield 17.5%DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[CH:7]=[C:6]([C:8]2[S:9][C:10]([C:14]3[N:19]=[C:18]([C:20]#[N:21])[CH:17]=[CH:16][CH:15]=3)=[CH:11][N:12]=2)[CH:5]=[N:4][CH:3]=1
Reaction #2254153
Yield 61.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:6][C:5]1[C:12]([Cl:14])=[CH:13][C:2]([Cl:1])=[CH:3][C:4]=1[C:9]([N:32]=[S:31]([CH:33]([CH3:35])[CH3:34])[CH:28]([CH3:30])[CH3:29])=[O:10]
Reaction #2254154
Yield 276.5%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:26][C:27]1[C:28]([N:33]2[C:37]([C:38]([NH:1][C:2]3[C:3]([C:4](=[O:5])[N:6]=[S:7]([CH:11]([CH3:13])[CH3:12])[CH:8]([CH3:9])[CH3:10])=[CH:14][C:15]([Cl:19])=[CH:16][C:17]=3[Cl:18])=[O:39])=[CH:36][C:35]([C:41]([F:44])([F:42])[F:43])=[N:34]2)=[N:29][CH:30]=[CH:31][CH:32]=1
Reaction #2254155
Yield 66.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:11][C:10]1[C:2]2[NH:1][C:13](=[O:14])[O:5][C:4](=[O:6])[C:3]=2[CH:7]=[C:8]([Cl:12])[CH:9]=1
Reaction #2254156
Yield 114.2%DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[C:7]2[N:8]=[C:9]([C:26]3[N:22]([C:17]4[C:16]([Cl:15])=[CH:21][CH:20]=[CH:19][N:18]=4)[N:23]=[C:24]([C:30]([F:31])([F:32])[F:33])[CH:25]=3)[O:10][C:11](=[O:12])[C:6]=2[CH:5]=[C:4]([Cl:14])[CH:3]=1
Reaction #2254157
Yield 64.2%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:20][C:21]1[C:22]([N:27]2[C:31]([C:32]([NH:12][C:3]3[C:4]([C:5]([OH:7])=[O:6])=[CH:8][C:9]([Cl:11])=[CH:10][C:2]=3[Cl:1])=[O:33])=[CH:30][C:29]([C:35]([F:38])([F:36])[F:37])=[N:28]2)=[N:23][CH:24]=[CH:25][CH:26]=1
Reaction #2254158
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:25][C:19]1[CH:18]=[C:17]([Cl:26])[C:16]2[N:15]=[C:13]([C:12]3[N:8]([C:3]4[C:2]([Cl:1])=[CH:7][CH:6]=[CH:5][N:4]=4)[N:9]=[C:10]([C:27]([F:29])([F:28])[F:30])[CH:11]=3)[O:23][C:22](=[O:24])[C:21]=2[CH:20]=1
Reaction #2254159
Yield 57.1%DOI: 10.6084/m9.figshare.5104873.v1
[CH:27]([O:14][CH:13]([CH3:12])[CH3:20])([CH3:40])[CH3:28]
Reaction #2254160
Yield 173.6%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:37]([OH:38])[C@H:35]1[O:36][C@H:31]([O:30][C@:21]2([CH2:20][OH:19])[O:25][C@H:24]([CH2:26][OH:27])[C@@H:23]([OH:28])[C@@H:22]2[OH:29])[C@H:32]([OH:52])[C@@H:33]([OH:40])[C@@H:34]1[OH:39]
Reaction #2254161
Yield 5.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:10][C:11](=[N:17][OH:18])[C:12](=[N:15][O:16][CH:2]([CH3:4])[CH3:3])[C:13]#[N:14]
Reaction #2254162
Yield 53.9%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:14][C:15](=[N:21][O:6][CH2:7][C:8]([F:9])([F:10])[F:11])[C:16](=[N:19][O:26][CH2:23][C:8]([F:11])([F:10])[F:9])[C:17]#[N:18]
Reaction #2254163
Yield 132.6%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:1][C:2](=[N:11][OH:12])[C:3](=[N:6][O:7][CH:8]([CH3:9])[CH3:10])[C:4]([NH2:5])=[O:19]
Reaction #2254164
Yield 63.0%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:1][C:2](=[N:11][O:12][CH:13]([CH3:15])[CH3:14])[C:3](=[N:6][O:7][CH:8]([CH3:9])[CH3:10])[C:4]([NH2:5])=[O:19]
Reaction #2254165
Yield 889.9%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C@H:2]1[CH2:33][C:32]([CH3:34])=[CH:31][C@@H:30]([CH2:35][CH:36]=[CH2:37])[C:28](=[O:29])[CH2:27][C@H:26]([OH:38])[C@@H:25]([CH3:39])[C@@H:24](/[C:40](/[CH3:51])=[CH:41]/[C@H:42]2[CH2:47][C@@H:46]([O:48][CH3:49])[C@H:45]([OH:50])[CH2:44][CH2:43]2)[O:23][C:21](=[O:22])[C@H:20]2[N:15]([CH2:16][CH2:17][CH2:18][CH2:19]2)[C:13](=[O:14])[C:11](=[O:12])[C@:9]2([OH:52])[O:10][C@@H:5]([C@@H:6]([O:54][CH3:55])[CH2:7][C@H:8]2[CH3:53])[C@@H:4]([O:56][CH3:57])[CH2:3]1
Reaction #2254166
DOI: 10.6084/m9.figshare.5104873.v1
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