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Dataset #521

[Br:3][C:4]1[CH:9]=[C:8]([Br:10])[N:7]=[C:6]([C:11]([O:13][CH3:14])=[O:12])[C:5]=1[O:15][CH2:16][C:17]1[CH:22]=[CH:21][CH:20]=[CH:19][CH:18]=1
Reaction #2336514
Yield 90.6%DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[N:7]=[C:6]([C:8]([Cl:24])=[O:9])[C:5]([O:11][CH2:12][C:13]2[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=2)=[C:4]([O:19][CH3:20])[CH:3]=1
Reaction #2336515
DOI: 10.6084/m9.figshare.5104873.v1
[Br:12][C:5]1[N:4]=[C:3]([C:8]([O:10][CH3:11])=[O:9])[C:2]([OH:1])=[CH:7][CH:6]=1
Reaction #2336516
Yield 70.7%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([O:8][C:9]1[CH:14]=[CH:13][CH:12]=[N+:11]([O-:24])[C:10]=1[C:15]([O:17][CH3:18])=[O:16])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
Reaction #2336517
Yield 94.6%DOI: 10.6084/m9.figshare.5104873.v1
[OH:1][C:2]1[C:7]([C:8]([OH:10])=[O:9])=[CH:6][N:5]=[CH:4][N:3]=1
Reaction #2336518
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([O:8][C:9]1[N:13]([CH3:14])[N:12]=[CH:11][C:10]=1[C:15]([OH:17])=[O:16])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
Reaction #2336519
Yield 90.3%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:7][C:8]1[CH:9]=[C:10]([CH:11]=[CH:12][CH:13]=1)[O:14][C:16]1[CH:17]=[C:18]([N+:22]([O-:24])=[O:23])[CH:19]=[CH:20][CH:21]=1
Reaction #2336520
DOI: 10.6084/m9.figshare.5104873.v1
[O:6]1[CH:10]=[CH:9][CH:8]=[C:7]1[C:11]1[CH:20]=[C:19]2[C:14]([C:15](=[N:24][OH:25])[CH:16]([CH3:21])[CH2:17][O:18]2)=[CH:13][CH:12]=1
Reaction #2336521
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]1([CH3:11])[C:2]([S:7]([O:29][N:28]=[C:21]2[C:20]3[C:25](=[CH:26][C:17]([C:13]4[O:12][CH:16]=[CH:15][CH:14]=4)=[CH:18][CH:19]=3)[O:24][CH2:23][CH:22]2[CH3:27])(=[O:9])=[O:8])=[CH:3][CH:4]=[CH:5][CH:6]=1
Reaction #2336522
Yield 57.1%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:14][C:15]([CH3:21])([CH3:19])[CH2:16][CH2:17][O:12][C:11]([C:2]1([CH3:1])[CH2:7][C:6]([CH3:8])([CH3:9])[CH2:5][C:4](=[O:10])[CH2:3]1)=[O:13]
Reaction #2336523
Yield 56.7%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:8][C:9]1[CH:16]=[CH:15][C:12]([CH2:13][N:5]2[CH2:6][CH2:7][CH:2]([OH:1])[CH2:3][CH2:4]2)=[CH:11][CH:10]=1
Reaction #2336524
Yield 51.6%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:11][C:12]1[CH:13]=[CH:14][C:15]([CH2:16][N:17]2[CH2:18][CH2:19][C:20](=[O:23])[CH2:21][CH2:22]2)=[CH:24][CH:25]=1
Reaction #2336525
Yield 81.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:8]1([CH2:14][CH2:15][C:16]([N:5]2[CH2:6][CH2:7][CH:2]([OH:1])[CH2:3][CH2:4]2)=[O:17])[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=1
Reaction #2336526
Yield 39.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:11]1([CH2:17][CH2:18][C:19]([N:21]2[CH2:26][CH2:25][C:24](=[O:27])[CH2:23][CH2:22]2)=[O:20])[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=1
Reaction #2336527
Yield 89.8%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:31][C:32]1[CH:37]=[CH:36][C:35]([CH2:38][CH2:39][NH:40][C:8]([C:3]2[C:2]([OH:1])=[CH:7][CH:6]=[CH:5][N:4]=2)=[O:10])=[CH:34][CH:33]=1
Reaction #2336528
Yield 70.5%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:39][C:6]1[CH:5]=[CH:4][C:3]([CH2:2][CH2:45][NH:42][C:26]([C:24]2[C:23]([OH:29])=[CH:22][CH:21]=[CH:20][N:25]=2)=[O:27])=[CH:16][CH:15]=1
Reaction #2336529
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:11][C:1]1[CH:6]=[CH:5][C:4]([S:7]([O:23][C:19]2[CH:18]=[CH:17][C:15]([O:16][S:7]([C:4]3[CH:5]=[CH:6][C:1]([CH3:11])=[CH:2][CH:3]=3)(=[O:9])=[O:8])=[C:14]([C:12]#[N:13])[C:20]=2[C:21]#[N:22])(=[O:9])=[O:8])=[CH:3][CH:2]=1
Reaction #2336530
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:5][CH2:4][CH2:3][CH:2]([CH3:7])[CH3:1]
Reaction #2336531
Yield 52.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:1]1([S:7][C:4]2[CH:5]=[CH:6][C:1]([S:7][C:1]3[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=3)=[C:2]([C:18]#[N:16])[C:3]=2[C:18]#[N:16])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1
Reaction #2336532
Yield 52.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][C:3]=1[S:8][C:2]1[CH:7]=[CH:6][C:5]([S:8][C:3]2[CH:4]=[CH:5][CH:6]=[CH:7][C:2]=2[CH3:1])=[C:4]([C:18]#[N:16])[C:3]=1[C:18]#[N:16]
Reaction #2336533
Yield 42.0%DOI: 10.6084/m9.figshare.5104873.v1
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