Toluene → HCID 66905365, compound

HRID 2151943Notes

Reaction equation

HRID 2151943 reaction equation
[CH2:23]([CH3:24])[O:25][C:26]([c:27]1[cH:28][cH:29][c:30]([N:33]=[C:34]=[O:35])[cH:31][cH:32]1)=[O:36].[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH:1]1([NH:7][c:8]2[n:9](-[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([N:7]([c:8]2[n:9](-[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[C:34]([NH:33][c:30]2[cH:29][cH:28][c:27]([C:26]([O:25][CH2:23][CH3:24])=[O:36])[cH:32][cH:31]2)=[O:35])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 589805Ethyl 4-isocyanatobenzoateHCID 12318206N-Cyclohexyl-2-phenyl-2H-indazol-3-amine

Product 1

HCID 66905365HCID 66905365, compound

Sources & evidence

ORD record
ord-168f616a3f2d4d6ba974ccbd4e591de8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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