Methanol → HCID 67207053, compound

HRID 1145427Notes

Reaction equation

HRID 1145427 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]1[CH2:9][N:10]([C:13](=[O:14])[N:15]2[C:16]([c:36]3[cH:37][n:38][c:39]([C:45]([CH3:46])([CH3:47])[CH3:48])[cH:40][c:41]3[O:42][CH2:43][CH3:44])=[N:17][C:18]([CH3:28])([c:29]3[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[C:19]2([CH3:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:49].[CH3:54][OH:55].[OH:56][C:57]([C:58]([F:59])([F:60])[F:61])=[O:62].[S:50]([Cl:51])([Cl:52])=[O:53]>>[NH2:7][CH:8]1[CH2:9][N:10]([C:13](=[O:14])[N:15]2[C:16]([c:36]3[cH:37][n:38][c:39]([C:45]([CH3:46])([CH3:47])[CH3:48])[cH:40][c:41]3[O:42][CH2:43][CH3:44])=[N:17][C:18]([CH3:28])([c:29]3[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[C:19]2([CH3:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 887MethanolHCID 6422Trifluoroacetic acidHCID 24386Thionyl ChlorideHCID 178466419HCID 178466419, compound

Product 1

HCID 67207053HCID 67207053, compound

Sources & evidence

ORD record
ord-2bd180fe1376444fbb3fa15c555e621e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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