Hydrochloric Acid → HCID 178468639, compound

HRID 1134673Notes

Reaction equation

HRID 1134673 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[NH:7][CH2:8][CH:9]([O:20][CH2:21][c:22]2[cH:23][cH:24][c:25]3[c:26]([cH:36]2)[N:27]([CH2:31][CH2:32][CH2:33][O:34][CH3:35])[CH2:28][CH2:29][O:30]3)[CH:10]([c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[CH2:11]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:55][N:56]([CH3:57])[c:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1.[ClH:65].[OH2:64].[c:44]1([CH3:54])[cH:45][cH:46][c:47]([S:50](=[O:51])(=[O:52])[Cl:53])[cH:48][cH:49]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[N:7]([S:50]([c:47]2[cH:46][cH:45][c:44]([CH3:54])[cH:49][cH:48]2)(=[O:51])=[O:52])[CH2:8][CH:9]([O:20][CH2:21][c:22]2[cH:23][cH:24][c:25]3[c:26]([cH:36]2)[N:27]([CH2:31][CH2:32][CH2:33][O:34][CH3:35])[CH2:28][CH2:29][O:30]3)[CH:10]([c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[CH2:11]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 73974-Toluenesulfonyl chlorideHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 178468638HCID 178468638, compound

Product 1

HCID 178468639HCID 178468639, compound

Sources & evidence

ORD record
ord-4cd0b07f61fa4d29a9a2625aea23b365
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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