Ammonium → HCID 66706900, compound

HRID 2339147Notes

Reaction equation

HRID 2339147 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([c:15]([S:20][C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1.[CH3:31][OH:32].[Cl-:28].[K+:27].[NH4+:29].[OH-:26].[OH2:30]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([c:15]([SH:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 813Potassium CationHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 576559793-tert-butoxycarbonyl-7-chloro-6-dimethylaminocarbonylthio-2,3,4,5-tetrahydro-1H-benzo[d]azepine

Product 1

HCID 66706900HCID 66706900, compound

Sources & evidence

ORD record
ord-59a8ea5a7b3f4a299f49142e172772bd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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