Toluene → HCID 70255146, compound

HRID 1201295Notes

Reaction equation

HRID 1201295 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([c:9]1[cH:10][n:11][cH:12][c:13]([O:15][CH2:16][CH3:17])[cH:14]1)[N:18]1[C:19](=[O:33])[N:20]([CH2:23][CH2:24][CH2:25][c:26]2[n:27][c:28]([Br:32])[cH:29][cH:30][cH:31]2)[CH2:21][CH2:22]1)=[O:34].[CH3:35][O:36][c:37]1[cH:38][cH:39][c:40]([CH2:41][NH2:42])[cH:43][cH:44]1.[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([c:9]1[cH:10][n:11][cH:12][c:13]([O:15][CH2:16][CH3:17])[cH:14]1)[N:18]1[C:19](=[O:33])[N:20]([CH2:23][CH2:24][CH2:25][c:26]2[n:27][c:28]([NH:42][CH2:41][c:40]3[cH:39][cH:38][c:37]([O:36][CH3:35])[cH:44][cH:43]3)[cH:29][cH:30][cH:31]2)[CH2:21][CH2:22]1)=[O:34]

Participants

4

Reactant 3

HCID 1140TolueneHCID 754524-MethoxybenzylamineHCID 57069756HCID 57069756, compound

Product 1

HCID 70255146HCID 70255146, compound

Sources & evidence

ORD record
ord-05e1493ec9bd4e19b5f8c63699e9bc62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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