Toluene → HCID 14418784, compound

HRID 112857Notes

Reaction equation

HRID 112857 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[O:9][c:10]1[cH:11][cH:12][c:13](-[c:16]2[s:17][c:18](-[c:21]3[cH:22][cH:23][c:24]([OH:27])[cH:25][cH:26]3)[n:19][n:20]2)[cH:14][cH:15]1.[CH2:35]([CH2:36][CH3:37])[CH:38]1[CH2:39][CH2:40][CH:41]([CH2:44][CH2:45][C:46](=[O:47])[Cl:48])[CH2:42][CH2:43]1.[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH3:56][N:57]([CH3:58])[c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[O:9][c:10]1[cH:11][cH:12][c:13](-[c:16]2[s:17][c:18](-[c:21]3[cH:22][cH:23][c:24]([O:27][C:46]([CH2:45][CH2:44][CH:41]4[CH2:40][CH2:39][CH:38]([CH2:35][CH2:36][CH3:37])[CH2:43][CH2:42]4)=[O:47])[cH:25][cH:26]3)[n:19][n:20]2)[cH:14][cH:15]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 14418783HCID 14418783, compoundHCID 135734288HCID 135734288, compound

Product 1

HCID 14418784HCID 14418784, compound

Sources & evidence

ORD record
ord-66ca086832fd4207879c8ca4e1a2d1cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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