Hydrochloric Acid → HCID 178449476, compound

HRID 1123797Notes

Reaction equation

HRID 1123797 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][CH:9]([C:10]([NH:11][C:12]([CH2:13][CH3:14])([c:15]1[n:16][cH:17][cH:18][cH:19][cH:20]1)[CH3:21])=[O:22])[NH:23][C:24](=[O:25])[c:26]1[cH:27][n:28][c:29]2[n:30]1[C:31]([CH2:44][c:45]1[cH:46][cH:47][c:48]([O:51][C:52]([F:53])([F:54])[F:55])[cH:49][cH:50]1)([CH3:56])[C:32](=[O:43])[N:33]2[c:34]1[cH:35][c:36]([Cl:42])[c:37]([F:41])[c:38]([Cl:40])[cH:39]1)=[O:57].[Cl:65][CH2:66][Cl:67].[ClH:58].[O:59]1[CH2:60][CH2:61][O:62][CH2:63][CH2:64]1>>[O:5]=[C:6]([CH2:7][CH2:8][CH:9]([C:10]([NH:11][C:12]([CH2:13][CH3:14])([c:15]1[n:16][cH:17][cH:18][cH:19][cH:20]1)[CH3:21])=[O:22])[NH:23][C:24](=[O:25])[c:26]1[cH:27][n:28][c:29]2[n:30]1[C:31]([CH2:44][c:45]1[cH:46][cH:47][c:48]([O:51][C:52]([F:53])([F:54])[F:55])[cH:49][cH:50]1)([CH3:56])[C:32](=[O:43])[N:33]2[c:34]1[cH:35][c:36]([Cl:42])[c:37]([F:41])[c:38]([Cl:40])[cH:39]1)[OH:57]

Participants

5

Sources & evidence

ORD record
ord-24985b17cdf74b31b43385eedd57c4dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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