p-Toluenesulfonic acid → HCID 178500795, compound

HRID 126469

Reaction equation

HRID 126469 reaction equation
[Br:28][CH:29]([C:30](=[O:31])[O:32][CH3:33])[CH3:34].[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH2:22])[CH2:23][CH:24]([CH3:25])[CH3:26])=[O:27].[CH3:35][N:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[CH3:42][C:43]#[N:44].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH:22][CH:29]([C:30](=[O:31])[O:32][CH3:33])[CH3:34])[CH2:23][CH:24]([CH3:25])[CH3:26])=[O:27]

Participants

6

Reactant 5

HCID 6101p-Toluenesulfonic acidHCID 6342AcetonitrileHCID 79724-MethylmorpholineHCID 95576Methyl 2-bromopropionateHCID 102682Benzyl 2-amino-4-methylpentanoate

Product 1

HCID 178500795HCID 178500795, compound

Sources & evidence

ORD record
ord-42eb4e9d09ae46fc86e370ddd59d793f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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