Dichloromethane → 4-(9-cyclopentyl-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-N-(1-BOC-piperidin-4-yl)benzamide
Reaction equation
[B-:31]([F:32])([F:33])([F:34])[F:35].[CH:1]1([N:6]2[c:7]3[c:8]([cH:15][n:16][c:17]([NH:19][c:20]4[c:21]([O:29][CH3:30])[cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28]4)[n:18]3)[N:9]([CH3:14])[C:10](=[O:13])[CH2:11][CH2:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[Cl:76][CH2:77][Cl:78].[NH2:62][CH:63]1[CH2:64][CH2:65][N:66]([C:69](=[O:70])[O:71][C:72]([CH3:73])([CH3:74])[CH3:75])[CH2:67][CH2:68]1.[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[CH:1]1([N:6]2[c:7]3[c:8]([cH:15][n:16][c:17]([NH:19][c:20]4[c:21]([O:29][CH3:30])[cH:22][c:23]([C:24](=[O:26])[NH:62][CH:63]5[CH2:64][CH2:65][N:66]([C:69](=[O:70])[O:71][C:72]([CH3:73])([CH3:74])[CH3:75])[CH2:67][CH2:68]5)[cH:27][cH:28]4)[n:18]3)[N:9]([CH3:14])[C:10](=[O:13])[CH2:11][CH2:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-c061c22601994a85838d1cce18f3b080
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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