Chloride → HCID 22457588, compound

HRID 1144842Notes

Reaction equation

HRID 1144842 reaction equation
[CH2:56]([Cl:57])[Cl:58].[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[N:12]2[N:13]([C:28](=[O:29])[OH:30])[CH2:14][CH:15]=[C:16]([S:19](=[O:20])(=[O:21])[c:22]3[n:23][cH:24][n:25]([CH3:27])[cH:26]3)[CH:17]=[CH:18]2)[cH:7][cH:8]1.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cl-:52].[Cl:31][C:32]([C:33]([Cl:34])=[O:35])=[O:36].[ClH:42].[ClH:55].[NH2:43][OH:44].[NH2:53][OH:54].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:59]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[N:12]2[N:13]([C:28](=[O:29])[NH:43][OH:44])[CH2:14][CH:15]=[C:16]([S:19](=[O:20])(=[O:21])[c:22]3[n:23][cH:24][n:25]([CH3:27])[cH:26]3)[CH:17]=[CH:18]2)[cH:7][cH:8]1

Participants

11

Reactant 10

HCID 312ChlorideHCID 313Hydrochloric Acid2×HCID 787Hydroxylamine2×HCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 70103910HCID 70103910, compound

Product 1

HCID 22457588HCID 22457588, compound

Sources & evidence

ORD record
ord-bb2ace3f83c74f36b17f2f3b01f60f25
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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