Methanol → HCID 178522853, compound

HRID 2327047Notes

Reaction equation

HRID 2327047 reaction equation
[CH2:27]1[O:28][CH2:29][CH2:30][CH2:31]1.[CH3:51][N:52]([CH3:53])[c:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1.[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[CH3:67][OH:68].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12][c:13]3[c:14]([F:24])[cH:15][c:16]([C:21](=[O:22])[OH:23])[cH:17][c:18]3[c:19]2[OH:20])[cH:25][cH:26]1.[Cl:36][c:37]1[cH:38][cH:39][c:40]([CH2:41][NH2:42])[cH:43][cH:44]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[S:32]([Cl:33])([Cl:34])=[O:35].[cH:45]1[cH:46][cH:47][n:48][cH:49][cH:50]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12][c:13]3[c:14]([F:24])[cH:15][c:16]([C:21](=[O:22])[NH:42][CH2:41][c:40]4[cH:39][cH:38][c:37]([Cl:36])[cH:44][cH:43]4)[cH:17][c:18]3[c:19]2[OH:20])[cH:25][cH:26]1

Participants

10

Reactant 9

HCID 887MethanolHCID 1049PyridineHCID 1140TolueneHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 24386Thionyl ChlorideHCID 660364-ChlorobenzylamineHCID 178524524HCID 178524524, compound

Product 1

HCID 178522853HCID 178522853, compound

Sources & evidence

ORD record
ord-63b1fad5a59348f397aa44bf9357b983
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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