Toluene → HCID 72553946, compound

HRID 1208930Notes

Reaction equation

HRID 1208930 reaction equation
[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[S:1]([Cl:2])([Cl:3])=[O:4].[c:5]1([CH:11]([CH3:12])[NH:13][c:14]2[c:15]3[c:16]([n:17][cH:18][n:19]2)[nH:20][c:21](-[c:23]2[cH:24][cH:25][c:26]([CH2:29][OH:30])[cH:27][cH:28]2)[cH:22]3)[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[Cl:3][CH2:29][c:26]1[cH:25][cH:24][c:23](-[c:21]2[nH:20][c:16]3[c:15]([c:14]([NH:13][CH:11]([c:5]4[cH:6][cH:7][cH:8][cH:9][cH:10]4)[CH3:12])[n:19][cH:18][n:17]3)[cH:22]2)[cH:28][cH:27]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 24386Thionyl ChlorideHCID 178463518HCID 178463518, compound

Product 1

HCID 72553946HCID 72553946, compound

Sources & evidence

ORD record
ord-d7e2b4dd690f40269e8c59a40a7381c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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