Toluene → HCID 13733072, compound

HRID 157252Notes

Reaction equation

HRID 157252 reaction equation
[CH3:20][C:21]([CH2:22][CH2:23][NH:24][CH2:25][c:26]1[cH:27][cH:28][c:29]([CH2:32][CH2:33][CH2:34][CH3:35])[cH:30][cH:31]1)([CH3:36])[CH3:37].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[c:1]1([O:2][C:8]([NH:9][c:10]2[c:11]([CH3:18])[cH:12][c:13]([Cl:17])[cH:14][c:15]2[CH3:16])=[O:19])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[c:11]([CH3:18])[cH:12][c:13]([Cl:17])[cH:14][c:15]1[CH3:16])(=[O:19])[N:24]([CH2:23][CH2:22][C:21]([CH3:20])([CH3:36])[CH3:37])[CH2:25][c:26]1[cH:27][cH:28][c:29]([CH2:32][CH2:33][CH2:34][CH3:35])[cH:30][cH:31]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 13733127HCID 13733127, compoundHCID 13733131HCID 13733131, compound

Product 1

HCID 13733072HCID 13733072, compound

Sources & evidence

ORD record
ord-12f9cb802d0a41e8bc58c4dd68a3f760
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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