Toluene → HCID 22132705, compound

HRID 1127616

Reaction equation

HRID 1127616 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH2:22])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:23][c:24]1[cH:25][c:26]([CH3:33])[c:27]([N:30]=[C:31]=[O:32])[cH:28][cH:29]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH:22][C:31]([NH:30][c:27]4[c:26]([CH3:33])[cH:25][c:24]([Cl:23])[cH:29][cH:28]4)=[O:32])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]

Participants

4

Reactant 3

HCID 1140TolueneHCID 1421574-Chloro-2-methylphenyl isocyanateHCID 115945434-[(6,7-Dimethoxyquinolin-4-yl)oxy]aniline

Product 1

HCID 22132705HCID 22132705, compound

Sources & evidence

ORD record
ord-00965f57e2914de89c375b285fc0e68d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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