Methanol → HCID 178437820, compound

HRID 696618Notes

Reaction equation

HRID 696618 reaction equation
[CH3:48][OH:49].[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:36][CH3:37])[CH2:14][N:15]([C:18]([CH:19]=[C:20]3[C:21](=[O:34])[N:22]([CH2:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[C:23](=[O:25])[S:24]3)=[O:35])[CH2:16][CH2:17]2)[nH:5][c:6]1[CH2:7][CH3:8].[Cl:38][CH2:39][Cl:40].[F:41][C:42]([F:43])([F:44])[C:45]([OH:46])=[O:47]>>[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:36][CH3:37])[CH2:14][N:15]([C:18]([CH:19]=[C:20]3[C:21](=[O:34])[N:22]([CH2:26][C:27](=[O:28])[OH:29])[C:23](=[O:25])[S:24]3)=[O:35])[CH2:16][CH2:17]2)[nH:5][c:6]1[CH2:7][CH3:8]

Participants

5

Sources & evidence

ORD record
ord-b4a8fac1f5bb4b1298a2ffdb8c0dd85b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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