Toluene → HCID 10388089, compound

HRID 1204488Notes

Reaction equation

HRID 1204488 reaction equation
[CH3:1][C:2]1([CH3:28])[O:3][c:4]2[c:5]([cH:7][cH:8][c:9](-[c:11]3[cH:12][c:13]([O:17][c:18]4[cH:19][cH:20][cH:21][c:22]5[c:23]4[n:24][c:25]([NH2:27])[s:26]5)[n:14][cH:15][n:16]3)[cH:10]2)[CH2:6]1.[CH3:29][C:30](=[O:31])[O:32][C:33](=[O:34])[CH3:35].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH3:1][C:2]1([CH3:28])[O:3][c:4]2[c:5]([cH:7][cH:8][c:9](-[c:11]3[cH:12][c:13]([O:17][c:18]4[cH:19][cH:20][cH:21][c:22]5[c:23]4[n:24][c:25]([NH:27][C:30]([CH3:29])=[O:31])[s:26]5)[n:14][cH:15][n:16]3)[cH:10]2)[CH2:6]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 7918Acetic AnhydrideHCID 21865279HCID 21865279, compound

Product 1

HCID 10388089HCID 10388089, compound

Sources & evidence

ORD record
ord-242147e90138427392a198aa26605aa3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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