Toluene → HCID 54157125, compound

HRID 204717Notes

Reaction equation

HRID 204717 reaction equation
[CH3:1][c:2]1[c:3]([O:4][CH2:5][c:6]2[c:7]([C:12]([C:13](=[O:14])[OH:15])=[N:16][O:17][CH3:18])[cH:8][cH:9][cH:10][cH:11]2)[cH:19][c:20]([CH3:23])[cH:21][cH:22]1.[CH3:24][N:25]([CH3:26])[CH:27]=[O:28].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[S:29]([Cl:30])([Cl:31])=[O:32]>>[CH3:1][c:2]1[c:3]([O:4][CH2:5][c:6]2[c:7]([C:12]([C:13](=[O:14])[Cl:31])=[N:16][O:17][CH3:18])[cH:8][cH:9][cH:10][cH:11]2)[cH:19][c:20]([CH3:23])[cH:21][cH:22]1

Participants

5

Sources & evidence

ORD record
ord-eca260ca26f54c2fa678a989e44dc494
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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