Ammonium → HCID 76556171, compound

HRID 679567Notes

Reaction equation

HRID 679567 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[c:10]([CH2:32][CH2:33][OH:34])[c:11]([NH:18][CH:19]2[CH2:20][N:21]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:22][CH2:23][CH2:24]2)[n:12][c:13]2[n:14]1[n:15][cH:16][cH:17]2)[c:35]1[cH:36][cH:37][c:38]([O:41][CH2:42][CH2:43][O:44][CH3:45])[cH:39][cH:40]1.[CH2:60]([Cl:61])[Cl:62].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][S:54]([Cl:55])(=[O:56])=[O:57].[Cl-:58].[NH4+:59]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[c:10]([CH2:32][CH2:33][O:34][S:54]([CH3:53])(=[O:56])=[O:57])[c:11]([NH:18][CH:19]2[CH2:20][N:21]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:22][CH2:23][CH2:24]2)[n:12][c:13]2[n:14]1[n:15][cH:16][cH:17]2)[c:35]1[cH:36][cH:37][c:38]([O:41][CH2:42][CH2:43][O:44][CH3:45])[cH:39][cH:40]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 76556153HCID 76556153, compound

Product 1

HCID 76556171HCID 76556171, compound

Sources & evidence

ORD record
ord-c86028768e1b4882ac7849cb5e4ca6c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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