Ammonium → HCID 178520278, compound

HRID 160207Notes

Reaction equation

HRID 160207 reaction equation
[C:5]([Cl:6])(=[O:7])[C:8]([Cl:9])=[O:10].[CH2:41]([Cl:42])[Cl:43].[CH3:1][S:2](=[O:3])[CH3:4].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[Cl-:39].[NH4+:40].[c:11]1(-[c:17]2[n:18][n:19]3[c:20]([cH:21][cH:22][cH:23][cH:24]3)[c:25]2[CH:26]=[CH:27][C:28](=[O:29])[N:30]2[CH:31]([CH2:36][CH2:37][OH:38])[CH2:32][CH2:33][CH2:34][CH2:35]2)[cH:12][cH:13][cH:14][cH:15][cH:16]1>>[c:11]1(-[c:17]2[n:18][n:19]3[c:20]([cH:21][cH:22][cH:23][cH:24]3)[c:25]2[CH:26]=[CH:27][C:28](=[O:29])[N:30]2[CH:31]([CH2:36][CH:37]=[O:38])[CH2:32][CH2:33][CH2:34][CH2:35]2)[cH:12][cH:13][cH:14][cH:15][cH:16]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 679Dimethyl SulfoxideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 54162572HCID 54162572, compound

Product 1

HCID 178520278HCID 178520278, compound

Sources & evidence

ORD record
ord-133dc70c2da4413399c6c304cd86ea69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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