Toluene → HCID 87421396, compound

HRID 302098Notes

Reaction equation

HRID 302098 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:22][c:23]2[n:24][cH:25][s:26][cH:27]2)[c:8](=[N:10][C:11]([c:12]2[c:13]([O:19][CH3:20])[cH:14][cH:15][c:16]([Cl:18])[cH:17]2)=[O:21])[s:9]1.[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([P:34]2(=[S:37])[S:35][P:36]([c:38]3[cH:39][cH:40][c:41]([O:42][CH3:43])[cH:44][cH:45]3)(=[S:46])[S:47]2)[cH:48][cH:49]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH3:57][CH2:58][O:59][C:60]([CH3:61])=[O:62]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:22][c:23]2[n:24][cH:25][s:26][cH:27]2)[c:8](=[N:10][C:11]([c:12]2[c:13]([O:19][CH3:20])[cH:14][cH:15][c:16]([Cl:18])[cH:17]2)=[S:37])[s:9]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 8857Ethyl AcetateHCID 87949Lawesson's reagentHCID 44230726HCID 44230726, compound

Product 1

HCID 87421396HCID 87421396, compound

Sources & evidence

ORD record
ord-4d8303917d194863aa05128548cb3663
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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