Toluene → HCID 53668420, compound

HRID 161498Notes

Reaction equation

HRID 161498 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([P:7]2(=[S:10])[S:8][P:9]([c:11]3[cH:12][cH:13][c:14]([O:15][CH3:16])[cH:17][cH:18]3)(=[S:19])[S:20]2)[cH:21][cH:22]1.[CH3:23][NH:24][C:25]([C:26](=[N:27][O:28][CH3:29])[c:30]1[c:31]([CH2:36][O:37][c:38]2[cH:39][c:40]([O:44][CH:45]([CH3:46])[CH3:47])[cH:41][cH:42][cH:43]2)[cH:32][cH:33][cH:34][cH:35]1)=[O:48].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[S:10]=[C:25]([NH:24][CH3:23])[C:26](=[N:27][O:28][CH3:29])[c:30]1[c:31]([CH2:36][O:37][c:38]2[cH:39][c:40]([O:44][CH:45]([CH3:46])[CH3:47])[cH:41][cH:42][cH:43]2)[cH:32][cH:33][cH:34][cH:35]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 87949Lawesson's reagentHCID 53681687HCID 53681687, compound

Product 1

HCID 53668420HCID 53668420, compound

Sources & evidence

ORD record
ord-17b9bff7213d41ed9c9a77fdbd7da673
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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