Ammonium → HCID 178422159, compound

HRID 692317Notes

Reaction equation

HRID 692317 reaction equation
[C:1]([Cl:2])(=[O:3])[C:4]([Cl:5])=[O:6].[CH3:11][c:12]1[c:13]([O:29][CH:30]([CH3:31])[c:32]2[c:33]([Cl:40])[cH:34][c:35]([CH2:38][OH:39])[cH:36][cH:37]2)[c:14]([C:26](=[O:27])[OH:28])[s:15][c:16]1-[c:17]1[cH:18][n:19][c:20]2[n:21]1[cH:22][cH:23][cH:24][cH:25]2.[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:7][S:8]([CH3:9])=[O:10].[Cl-:41].[Cl:43][CH2:44][Cl:45].[NH4+:42]>>[CH3:11][c:12]1[c:13]([O:29][CH:30]([CH3:31])[c:32]2[c:33]([Cl:40])[cH:34][c:35]([CH:38]=[O:39])[cH:36][cH:37]2)[c:14]([C:26](=[O:27])[OH:28])[s:15][c:16]1-[c:17]1[cH:18][n:19][c:20]2[n:21]1[cH:22][cH:23][cH:24][cH:25]2

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 679Dimethyl SulfoxideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 178422160HCID 178422160, compound

Product 1

HCID 178422159HCID 178422159, compound

Sources & evidence

ORD record
ord-3d8f716d459041f382f0edcc8840c087
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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