Water → HCID 178485215, compound

HRID 2317522Notes

Reaction equation

HRID 2317522 reaction equation
[CH3:37][NH2:38].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[c:14]2[n:15][n:16](-[c:29]3[c:30]([Cl:36])[cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[c:17]3[c:23]2[CH2:22][CH2:21][CH2:20][c:19]2[c:18]-3[cH:27][cH:26][c:25]([Cl:28])[cH:24]2)[cH:6][cH:7]1.[Cl:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Cl:46][CH2:47][Cl:48].[OH2:49]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]=[C:12]([c:14]2[n:15][n:16](-[c:29]3[c:30]([Cl:36])[cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[c:17]3[c:23]2[CH2:22][CH2:21][CH2:20][c:19]2[c:18]-3[cH:27][cH:26][c:25]([Cl:28])[cH:24]2)[NH:38][CH3:37])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6329MethylamineHCID 6344DichloromethaneHCID 7964ChlorobenzeneHCID 67309468HCID 67309468, compound

Product 1

HCID 178485215HCID 178485215, compound

Sources & evidence

ORD record
ord-9ddb060887384eb8a2eec37f2dc85c48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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