Toluene → HCID 86600782, compound

HRID 136000Notes

Reaction equation

HRID 136000 reaction equation
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:1][C:2]1([CH3:21])[O:3][CH2:4][C:5](=[O:20])[NH:6][c:7]2[c:8]1[cH:9][c:10](-[c:13]1[cH:14][cH:15][c:16]([C:18]#[N:19])[nH:17]1)[cH:11][cH:12]2.[CH3:22][O:23][c:24]1[cH:25][cH:26][c:27]([P:28]2(=[S:31])[S:29][P:30]([c:32]3[cH:33][cH:34][c:35]([O:36][CH3:37])[cH:38][cH:39]3)(=[S:40])[S:41]2)[cH:42][cH:43]1.[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[CH3:1][C:2]1([CH3:21])[O:3][CH2:4][C:5](=[S:31])[NH:6][c:7]2[c:8]1[cH:9][c:10](-[c:13]1[cH:14][cH:15][c:16]([C:18]#[N:19])[nH:17]1)[cH:11][cH:12]2

Participants

5

Reactant 4

HCID 1140TolueneHCID 8028TetrahydrofuranHCID 87949Lawesson's reagentHCID 44579751HCID 44579751, compound

Product 1

HCID 86600782HCID 86600782, compound

Sources & evidence

ORD record
ord-b4d4ec15acb24352a945a67c836d3b65
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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