1,2-Dichloroethane → HCID 178490093, compound

HRID 698960Notes

Reaction equation

HRID 698960 reaction equation
[CH2:56]([Cl:57])[CH2:58][Cl:59].[Cl:13][CH2:14][CH2:15][CH2:16][C:17]([C:18](=[O:19])[OH:20])=[CH:21][c:22]1[cH:23][c:24]([O:34][CH3:35])[c:25](-[n:28]2[cH:29][n:30][c:31]([CH3:33])[cH:32]2)[cH:26][cH:27]1.[F:36][c:37]1[cH:38][cH:39][c:40]([CH:43]([CH3:44])[NH2:45])[cH:41][cH:42]1.[F:6][C:7]([F:8])([F:9])[C:10]([OH:11])=[O:12].[O:1]=[CH:2][N:3]([CH3:4])[CH3:5].[OH:46][n:47]1[c:48]2[c:49]([cH:50][cH:51][cH:52][cH:53]2)[n:54][n:55]1>>[Cl:13][CH2:14][CH2:15][CH2:16][C:17]([C:18](=[O:20])[NH:45][CH:43]([c:40]1[cH:39][cH:38][c:37]([F:36])[cH:42][cH:41]1)[CH3:44])=[CH:21][c:22]1[cH:23][c:24]([O:34][CH3:35])[c:25](-[n:28]2[cH:29][n:30][c:31]([CH3:33])[cH:32]2)[cH:26][cH:27]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 757711-HydroxybenzotriazoleHCID 1230631-(4-Fluorophenyl)ethylamineHCID 668396445-Chloro-2-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]pentanoic acid

Product 1

HCID 178490093HCID 178490093, compound

Sources & evidence

ORD record
ord-afc7aaafd0b24d5c949fb41fd152b70d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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