Ammonium → HCID 11475935, compound

HRID 1228353Notes

Reaction equation

HRID 1228353 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:7]([CH2:8][c:9]1[cH:10][c:11]([C:15](=[O:16])[N:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:12][cH:13][cH:14]1)[CH2:23][CH2:24][NH:25][c:26]1[c:27]([NH:32][S:33](=[O:34])(=[O:35])[CH3:36])[cH:28][cH:29][cH:30][cH:31]1)([CH3:5])([CH3:6])[CH3:37].[C:38]([O:39][C:40](=[O:41])[N:42]([CH2:43][CH2:44][NH:45][c:46]1[cH:47][cH:48][cH:49][cH:50][c:51]1[NH2:52])[CH2:53][c:54]1[cH:55][cH:56][cH:57][c:58]([C:59]([N:60]2[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65]2)=[O:66])[cH:67]1)([CH3:68])([CH3:69])[CH3:70].[CH3:71][CH2:72][N:73]([CH2:74][CH3:75])[CH2:76][CH3:77].[CH3:78][S:79](=[O:80])(=[O:81])[Cl:82].[Cl-:83].[Cl:85][CH2:86][Cl:87].[NH4+:84].[OH2:88]>>[NH:7]([CH2:8][c:9]1[cH:10][c:11]([C:15](=[O:16])[N:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:12][cH:13][cH:14]1)[CH2:23][CH2:24][NH:25][c:26]1[c:27]([NH:32][S:33](=[O:34])(=[O:35])[CH3:36])[cH:28][cH:29][cH:30][cH:31]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 67045852HCID 67045852, compoundHCID 67046058HCID 67046058, compound

Product 1

HCID 11475935HCID 11475935, compound

Sources & evidence

ORD record
ord-b61253c39b41432d80b9b33b480966d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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