Chloride → HCID 595083, compound

HRID 126649Notes

Reaction equation

HRID 126649 reaction equation
[CH3:12][CH2:13][N:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH3:31][C:32]#[N:33].[Cl-:19].[Cl-:1].[Cl:2][CH2:3][C:4](=[NH2+:5])[N:6]1[CH2:7][CH2:8][O:9][CH2:10][CH2:11]1.[c:20]1([CH3:30])[cH:21][cH:22][c:23]([S:26](=[O:27])(=[O:28])[OH:29])[cH:24][cH:25]1>>[Cl:2][CH2:3][C:4](=[N:5][S:26]([c:23]1[cH:22][cH:21][c:20]([CH3:30])[cH:25][cH:24]1)(=[O:27])=[O:28])[N:6]1[CH2:7][CH2:8][O:9][CH2:10][CH2:11]1

Participants

6

Reactant 5

HCID 312Chloride2×HCID 6101p-Toluenesulfonic acidHCID 6342AcetonitrileHCID 8471TriethylamineHCID 178514181HCID 178514181, compound

Product 1

HCID 595083HCID 595083, compound

Sources & evidence

ORD record
ord-04ac2d9277e640e78a91a105b8d45be8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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