Water → HCID 178447585, compound

HRID 157904Notes

Reaction equation

HRID 157904 reaction equation
[C:34]([C:35]([CH3:36])([CH3:37])[CH3:38])(=[O:39])[O:40][CH2:41][I:42].[NH2:1][c:2]1[s:3][c:4]([Cl:32])[c:5]([C:7]([C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[S:13][CH2:14][C:15]([S:23][c:24]4[s:25][c:26]([NH2:29])[n:27][n:28]4)=[C:16]([C:20](=[O:21])[OH:22])[N:17]3[C:18]2=[O:19])=[N:30][OH:31])[n:6]1.[Na:33].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH2:43]>>[NH2:1][c:2]1[s:3][c:4]([Cl:32])[c:5]([C:7]([C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[S:13][CH2:14][C:15]([S:23][c:24]4[s:25][c:26]([NH2:29])[n:27][n:28]4)=[C:16]([C:20]([O:21][CH2:41][O:40][C:34]([C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])=[O:22])[N:17]3[C:18]2=[O:19])=[N:30][OH:31])[n:6]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 104401Iodomethyl pivalateHCID 5360545SodiumHCID 178509200HCID 178509200, compound

Product 1

HCID 178447585HCID 178447585, compound

Sources & evidence

ORD record
ord-7f28e3ca01ad4ff4b357950f645988c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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