Water → HCID 44129699, compound

HRID 123203Notes

Reaction equation

HRID 123203 reaction equation
[CH3:45][C:46]#[N:47].[F:1][CH:2]([O:3][c:4]1[c:5](-[c:14]2[c:15]([O:25][C:26]([CH:27]([CH3:28])[CH3:29])=[O:30])[c:16]3[c:17]([n:18][cH:19][cH:20][n:21]3)[nH:22][c:23]2=[O:24])[c:6]([C:10]([F:11])([F:12])[F:13])[n:7][n:8]1[CH3:9])[F:31].[OH2:44].[S:32]([O:33][CH2:40][CH:41]([F:42])[F:43])([C:34]([F:35])([F:36])[F:37])(=[O:38])=[O:39]>>[F:1][CH:2]([O:3][c:4]1[c:5](-[c:14]2[c:15]([O:25][C:26]([CH:27]([CH3:28])[CH3:29])=[O:30])[c:16]3[c:17]([n:18][cH:19][cH:20][n:21]3)[n:22]([CH2:40][CH:41]([F:42])[F:43])[c:23]2=[O:24])[c:6]([C:10]([F:11])([F:12])[F:13])[n:7][n:8]1[CH3:9])[F:31]

Participants

5

Sources & evidence

ORD record
ord-73f9a83d02244e218ce281971394d5ed
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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