HCID 59731929, compound → HCID 143577149, compound

HRID 311048Notes

Reaction equation

HRID 311048 reaction equation
[Cl:18][c:19]1[cH:20][c:21]2[c:22]([c:23]3[cH:24][n:25][nH:26][c:27]13)[CH2:28][N:29]([CH2:54][C:55]([CH3:56])([CH3:57])[CH3:58])[C:30](=[O:53])[CH:31]([CH2:33][C:34]([N:35]1[CH2:36][CH2:37][CH:38]([N:39]3[CH2:40][c:41]4[c:42]([cH:43][cH:44][cH:45][cH:46]4)[NH:47][C:48]3=[O:49])[CH2:50][CH2:51]1)=[O:52])[CH2:32]2.[NH:1]1[CH2:2][CH2:3][CH:4]([c:7]2[c:8](=[O:17])[nH:9][c:10]3[n:11][cH:12][cH:13][cH:14][c:15]3[cH:16]2)[CH2:5][CH2:6]1>>[N:1]1([C:34]([CH2:33][CH:31]2[C:30](=[O:53])[N:29]([CH2:54][C:55]([CH3:56])([CH3:57])[CH3:58])[CH2:28][c:22]3[c:21]([cH:20][c:19]([Cl:18])[c:27]4[c:23]3[cH:24][n:25][nH:26]4)[CH2:32]2)=[O:52])[CH2:2][CH2:3][CH:4]([c:7]2[c:8](=[O:17])[nH:9][c:10]3[n:11][cH:12][cH:13][cH:14][c:15]3[cH:16]2)[CH2:5][CH2:6]1

Participants

3

Reactant 2

HCID 59731929HCID 59731929, compoundHCID 688264784-Chloro-9-(2,2-dimethylpropyl)-7-[2-oxo-2-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]ethyl]-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-8-one

Product 1

HCID 143577149HCID 143577149, compound

Sources & evidence

ORD record
ord-5ad5f7363ee34ff1bf69085be0942437
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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