Ammonium → HCID 66974418, compound

HRID 700393Notes

Reaction equation

HRID 700393 reaction equation
[CH3:10][O:11][C:12]([CH2:13][CH:14]1[N:15]=[C:16]([c:19]2[nH:20][c:21]3[c:22]([N+:30](=[O:31])[O-:32])[cH:23][c:24]([CH2:28][Cl:29])[cH:25][c:26]3[cH:27]2)[S:17][CH2:18]1)=[O:33].[Cl-:34].[H-:9].[NH4+:35].[Na+:8].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[OH:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:28][c:24]1[cH:23][c:22]([N+:30](=[O:31])[O-:32])[c:21]2[nH:20][c:19]([C:16]3=[N:15][CH:14]([CH2:13][C:12]([O:11][CH3:10])=[O:33])[CH2:18][S:17]3)[cH:27][c:26]2[cH:25]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium ionHCID 996PhenolHCID 6228DimethylformamideHCID 166653HydrideHCID 66974294methyl 2-[2-[5-(chloromethyl)-7-nitro-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-4-yl]acetate

Product 1

HCID 66974418HCID 66974418, compound

Sources & evidence

ORD record
ord-0dbd73035659485d9d3a5c06bb68a5f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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