Toluene → HCID 21274226, compound

HRID 2338018Notes

Reaction equation

HRID 2338018 reaction equation
[CH3:38][N:39]([CH3:40])[c:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[Cl:1][c:2]1[c:3]([O:4][CH:5]([C:6](=[O:7])[OH:8])[CH3:9])[cH:10][c:11](-[n:15]2[n:16][c:17]([CH3:24])[n:18]([CH:21]([F:22])[F:23])[c:19]2=[O:20])[c:12]([F:14])[cH:13]1.[c:25]1([CH3:37])[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[N:34]=[C:35]=[O:36])[cH:29][cH:30]1>>[Cl:1][c:2]1[c:3]([O:4][CH:5]([C:6](=[O:7])[NH:34][S:31]([c:28]2[cH:27][cH:26][c:25]([CH3:37])[cH:30][cH:29]2)(=[O:32])=[O:33])[CH3:9])[cH:10][c:11](-[n:15]2[n:16][c:17]([CH3:24])[n:18]([CH:21]([F:22])[F:23])[c:19]2=[O:20])[c:12]([F:14])[cH:13]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 142844-(Dimethylamino)pyridineHCID 77703p-Toluenesulfonyl isocyanateHCID 13769460HCID 13769460, compound

Product 1

HCID 21274226HCID 21274226, compound

Sources & evidence

ORD record
ord-bcaacdf9044240b5bea5b042e9bb9b03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…