1,2-Dichloroethane → HCID 67299920, compound

HRID 2330827Notes

Reaction equation

HRID 2330827 reaction equation
[CH2:47]([Cl:48])[CH2:49][Cl:50].[CH2:58]([Cl:59])[Cl:60].[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[NH2:1][CH:2]([C:3](=[O:4])[N:5]1[CH2:6][C:7]([CH3:19])([CH3:20])[C:8]([OH:11])([c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[CH2:9][CH2:10]1)[CH:21]([CH3:22])[CH3:23].[OH:37][n:38]1[c:39]2[c:40]([cH:41][cH:42][cH:43][cH:44]2)[n:45][n:46]1.[S:24]([NH2:25])(=[O:26])(=[O:27])[c:28]1[cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35][cH:36]1>>[NH:1]([CH:2]([C:3](=[O:4])[N:5]1[CH2:6][C:7]([CH3:19])([CH3:20])[C:8]([OH:11])([c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[CH2:9][CH2:10]1)[CH:21]([CH3:22])[CH3:23])[C:31]([c:30]1[cH:29][c:28]([S:24]([NH2:25])(=[O:26])=[O:27])[cH:36][cH:35][cH:34]1)=[O:32]

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 6344DichloromethaneHCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 2293523-Sulfamoylbenzoic acidHCID 670924982-Amino-1-[4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methylbutan-1-one

Product 1

HCID 67299920HCID 67299920, compound

Sources & evidence

ORD record
ord-50c6361c24c04c13b857ca2f2cb4ad26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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