Water → HCID 178516306, compound

HRID 682353Notes

Reaction equation

HRID 682353 reaction equation
[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[CH3:8][CH2:9][N:10]([CH2:11][CH3:12])[CH2:13][CH3:14].[Cl:15][CH2:16][c:17]1[n:18]([O:38][CH:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:19][c:20]([O:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:21](=[O:23])[cH:22]1.[OH2:57].[SH:1][c:2]1[s:3][c:4]([SH:7])[n:5][n:6]1>>[S:1]([c:2]1[s:3][c:4]([SH:7])[n:5][n:6]1)[CH2:16][c:17]1[n:18]([O:38][CH:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:19][c:20]([O:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:21](=[O:23])[cH:22]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 199180692-(Chloromethyl)-1,5-bis(diphenylmethoxy)pyridin-4(1H)-oneHCID 178418558HCID 178418558, compound

Product 1

HCID 178516306HCID 178516306, compound

Sources & evidence

ORD record
ord-9bb3bffe9d7a454eb821c85104cfd882
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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