Water → HCID 13631269, compound

HRID 2143430Notes

Reaction equation

HRID 2143430 reaction equation
[CH2:20]([NH+:21]([CH2:22][CH3:23])[CH2:24][CH3:25])[CH3:26].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[N:14]2[C:15](=[O:19])[CH:16]([NH2:18])[CH2:17]2)[cH:6][cH:7]1.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:44][C:45]#[N:46].[OH2:47].[c:34]1([CH2:40][C:41](=[O:42])[Cl:43])[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[N:14]2[C:15](=[O:19])[CH:16]([NH:18][C:41]([CH2:40][c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)=[O:42])[CH2:17]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6342AcetonitrileHCID 7679Phenylacetyl chlorideHCID 8471TriethylamineHCID 1385867TriethylammoniumHCID 23322466HCID 23322466, compound

Product 1

HCID 13631269HCID 13631269, compound

Sources & evidence

ORD record
ord-3cade181908c4cc395e84595d765d158
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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