Methanol → HCID 168313573, compound

HRID 1152580Notes

Reaction equation

HRID 1152580 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:9]([cH:10][cH:11]1)[NH:8][C:7](=[O:12])[C:6]2=[CH:13][c:14]1[cH:15][cH:16][c:17]2[c:18]([CH:23]=[CH:24][c:25]3[cH:26][n:27][c:28]([N:31]4[CH2:32][CH2:33][N:34]([CH3:37])[CH2:35][CH2:36]4)[cH:29][cH:30]3)[n:19][nH:20][c:21]2[cH:22]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:45][CH2:46][O:47][CH2:48][CH3:49].[CH3:57][OH:58].[Cl:50][CH2:51][Cl:52].[Cl:53][CH:54]([Cl:55])[Cl:56]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:9]([cH:10][cH:11]1)[NH:8][C:7](=[O:12])[C:6]21[CH:13]([c:14]2[cH:15][cH:16][c:17]3[c:18]([CH:23]=[CH:24][c:25]4[cH:26][n:27][c:28]([N:31]5[CH2:32][CH2:33][N:34]([CH3:37])[CH2:35][CH2:36]5)[cH:29][cH:30]4)[n:19][nH:20][c:21]3[cH:22]2)[CH2:38]1

Participants

7

Sources & evidence

ORD record
ord-16fd93dbc6594825a2cb437129329c02
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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