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Dataset #440

[C:1]([C:3](=[CH:20][C:19]1[CH:22]=[CH:23][C:24]([O:25][CH3:26])=[C:17]([N:16]([CH3:27])[CH3:15])[CH:18]=1)[C:4]([NH:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C:12]([OH:14])=[O:13])=[O:5])#[N:2]
Reaction #1929063
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:14]([O:1][C:2]1[CH:3]=[C:4]([CH:7]=[CH:8][CH:9]=1)[CH2:5][OH:6])[C:13]#[CH:12]
Reaction #1929064
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:13]2[CH:14]=[CH:15][C:16]([CH3:23])=[C:17]([CH2:19][C:20]([OH:22])=[O:21])[CH:18]=2)=[CH:4][C:3]=1[F:11]
Reaction #1929065
DOI: 10.6084/m9.figshare.5104873.v1
[NH2:9][C:5]1([C:6]([OH:15])=[O:11])[CH2:12][CH2:13][C:2]([F:14])([F:1])[CH2:3][CH2:4]1
Reaction #1929066
DOI: 10.6084/m9.figshare.5104873.v1
[ClH:15]
Reaction #1929067
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:13]=[CH:12][C:11]([CH3:14])=[C:10]([CH2:15][C:16]([NH:30][C:31]3([C:39]([O:41][CH3:42])=[O:40])[CH2:36][CH2:35][C:34]([F:38])([F:37])[CH2:33][CH2:32]3)=[O:18])[CH:9]=2)=[CH:4][C:3]=1[F:19]
Reaction #1929068
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:22][C:23]1[CH:24]=[CH:25][C:26]([C:29]2[CH:34]=[CH:33][C:32]([CH3:35])=[C:31]([CH2:36][C:37]([NH:2][C:3]3([C:11]([O:13][CH3:14])=[O:12])[CH2:8][CH2:7][C:6]([F:10])([F:9])[CH2:5][CH2:4]3)=[O:38])[CH:30]=2)=[CH:27][CH:28]=1
Reaction #1929069
DOI: 10.6084/m9.figshare.5104873.v1
[F:9][C:6]1([F:10])[CH2:7][CH2:8][C:3]([NH:2][C:37](=[O:38])[CH2:36][C:31]2[CH:30]=[C:29]([C:26]3[CH:27]=[CH:28][C:23]([F:22])=[CH:24][CH:25]=3)[CH:34]=[CH:33][C:32]=2[CH3:35])([C:11]([O:13][CH3:14])=[O:12])[CH2:4][CH2:5]1
Reaction #1929070
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:22][C:23]1[CH:28]=[CH:27][C:26]([C:29]2[CH:30]=[CH:31][C:32]([Cl:35])=[CH:33][CH:34]=2)=[CH:25][C:24]=1[CH2:36][C:37]([NH:2][C:3]1([C:11]([O:13][CH3:14])=[O:12])[CH2:8][CH2:7][C:6]([F:10])([F:9])[CH2:5][CH2:4]1)=[O:38]
Reaction #1929071
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:22][C:23]1[CH:24]=[CH:25][C:26]([C:29]2[CH:34]=[CH:33][C:32]([CH3:35])=[C:31]([CH2:36][C:37]([NH:2][C:3]3([C:11]([O:13][CH3:14])=[O:12])[CH2:8][CH2:7][C:6]([F:10])([F:9])[CH2:5][CH2:4]3)=[O:38])[C:30]=2[CH3:40])=[CH:27][CH:28]=1
Reaction #1929072
DOI: 10.6084/m9.figshare.5104873.v1
[Br:5][C:6]1[CH:7]=[CH:8][C:9]([CH3:16])=[C:10]([CH2:12][C:13]([NH:18][C:19]2([C:27]([O:29][CH3:30])=[O:28])[CH2:24][CH2:23][C:22]([F:26])([F:25])[CH2:21][CH2:20]2)=[O:15])[CH:11]=1
Reaction #1929073
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[CH:3]=[CH:4][C:5]([CH3:24])=[C:6]([C:8]2[C:9](=[O:10])[NH:11][C:12]3([CH2:13][CH2:14][C:15]([F:19])([F:18])[CH2:16][CH2:17]3)[C:20]=2[OH:21])[CH:7]=1
Reaction #1929074
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[CH:3]=[CH:4][C:5]([CH3:12])=[C:6]([CH2:8][C:9]([NH:18][C:19]2([C:25]([O:27][CH3:28])=[O:26])[CH2:24][CH2:23][CH2:22][CH2:21][CH2:20]2)=[O:11])[CH:7]=1
Reaction #1929075
DOI: 10.6084/m9.figshare.5104873.v1
[Br:7][C:8]1[CH:9]=[CH:10][C:11]([CH3:28])=[C:12]([C:14]2[C:15](=[O:16])[NH:17][C:18]3([CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]3)[C:24]=2[OH:26])[CH:13]=1
Reaction #1929076
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:13]=[CH:12][C:11]([CH3:14])=[C:10]([CH2:15][C:16]([Cl:21])=[O:18])[CH:9]=2)=[CH:4][CH:3]=1
Reaction #1929077
Yield 100.9%DOI: 10.6084/m9.figshare.5104873.v1
[Cl:21][C:22]1[CH:27]=[CH:26][C:25]([C:2]2[CH:3]=[CH:4][C:5]([CH3:20])=[C:6]([C:8]3[C:9](=[O:19])[NH:10][C:11]4([CH2:18][CH2:17][CH2:16][CH2:15][CH2:14]4)[C:12]=3[OH:13])[CH:7]=2)=[CH:24][C:23]=1[F:31]
Reaction #1929078
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:7][C:8]1[CH:13]=[CH:12][C:11]([C:14]2[CH:19]=[CH:18][C:17]([CH3:20])=[C:16]([C:21]3[C:22](=[O:23])[NH:24][C:25]4([CH2:30][CH2:29][C:28]([F:31])([F:32])[CH2:27][CH2:26]4)[C:33]=3[OH:35])[CH:15]=2)=[CH:10][C:9]=1[F:37]
Reaction #1929079
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:7][C:8]1[CH:13]=[CH:12][C:11]([C:14]2[CH:19]=[CH:18][C:17]([CH3:20])=[C:16]([C:21]3[C:22](=[O:23])[NH:24][C:25]4([CH2:30][CH2:29][C:28]([F:31])([F:32])[CH2:27][CH2:26]4)[C:33]=3[OH:35])[CH:15]=2)=[CH:10][CH:9]=1
Reaction #1929080
DOI: 10.6084/m9.figshare.5104873.v1
[F:30][C:2]1([F:1])[CH2:7][CH2:6][C:5]2([NH:12][C:13](=[O:29])[C:14]([C:15]3[CH:16]=[C:17]([C:22]4[CH:23]=[CH:24][C:25]([F:28])=[CH:26][CH:27]=4)[CH:18]=[CH:19][C:20]=3[CH3:21])=[C:8]2[OH:9])[CH2:4][CH2:3]1
Reaction #1929081
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:43][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:9]=[CH:10][C:11]([Cl:14])=[CH:12][CH:13]=2)=[CH:4][C:3]=1[C:15]1[C:16](=[O:17])[NH:18][C:19]2([CH2:20][CH2:21][C:22]([F:25])([F:26])[CH2:23][CH2:24]2)[C:27]=1[OH:29]
Reaction #1929082
DOI: 10.6084/m9.figshare.5104873.v1
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