Hydrochloric Acid → HCID 178485861, compound

HRID 314639Notes

Reaction equation

HRID 314639 reaction equation
[C:43](#[N:44])[c:45]1[cH:46][cH:47][c:48]([C:49](=[O:50])[Cl:51])[cH:52][cH:53]1.[ClH:1].[F:2][C:3]([c:4]1[cH:5][c:6]([N:14]([C:15](=[O:16])[N:17]([CH3:18])[CH:19]2[CH:20]([c:33]3[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]3)[CH2:21][N:22]([C:25](=[O:26])[CH:27]3[NH:28][CH2:29][CH2:30][CH2:31][CH2:32]3)[CH2:23][CH2:24]2)[CH3:40])[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1)([F:41])[F:42]>>[F:2][C:3]([c:4]1[cH:5][c:6]([N:14]([C:15](=[O:16])[N:17]([CH3:18])[CH:19]2[CH:20]([c:33]3[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]3)[CH2:21][N:22]([C:25](=[O:26])[CH:27]3[N:28]([C:49]([c:48]4[cH:47][cH:46][c:45]([C:43]#[N:44])[cH:53][cH:52]4)=[O:50])[CH2:29][CH2:30][CH2:31][CH2:32]3)[CH2:23][CH2:24]2)[CH3:40])[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1)([F:41])[F:42]

Participants

4

Sources & evidence

ORD record
ord-6439cc654eda43ba95f05407deb6b0d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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