Toluene → HCID 18770637, compound

HRID 2159874Notes

Reaction equation

HRID 2159874 reaction equation
[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH:11]1([C:17]([CH:18]=[O:19])([CH3:20])[CH3:21])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH2:8])[cH:9][cH:10]1.[c:31]1([CH3:32])[cH:33][cH:34][c:35]([S:36]([OH:37])(=[O:38])=[O:39])[cH:40][cH:41]1.[nH:22]1[n:23][n:24][c:25]2[c:26]1[cH:27][cH:28][cH:29][cH:30]2>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:8][CH:18]([C:17]([CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)([CH3:20])[CH3:21])[n:22]2[n:23][n:24][c:25]3[c:26]2[cH:27][cH:28][cH:29][cH:30]3)[cH:9][cH:10]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 120844-ChlorobenzamideHCID 1400235028523-30-0HCID 178418385HCID 178418385, compound

Product 1

HCID 18770637HCID 18770637, compound

Sources & evidence

ORD record
ord-fb6ca447b36e4953907cb79d165adf58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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