Chloride → HCID 15547420, compound

HRID 194268Notes

Reaction equation

HRID 194268 reaction equation
[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[CH:5]1([n:10]2[n:11][c:12]([CH2:22][CH3:23])[c:13]3[cH:14][cH:15][c:16]([C:19](=[O:20])[OH:21])[cH:17][c:18]23)[CH2:6][CH2:7][CH2:8][CH2:9]1.[Cl-:35].[H-:24].[NH2:26][c:27]1[c:28]([Cl:34])[n:29][cH:30][n:31][c:32]1[Cl:33].[Na+:25].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[S:1]([Cl:2])([Cl:3])=[O:4]>>[CH:5]1([n:10]2[n:11][c:12]([CH2:22][CH3:23])[c:13]3[cH:14][cH:15][c:16]([C:19](=[O:21])[NH:26][c:27]4[c:28]([Cl:34])[n:29][cH:30][n:31][c:32]4[Cl:33])[cH:17][c:18]23)[CH2:6][CH2:7][CH2:8][CH2:9]1

Participants

10

Reactant 9

HCID 312ChlorideHCID 923Sodium ionHCID 1140TolueneHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 24386Thionyl ChlorideHCID 794345-Amino-4,6-dichloropyrimidineHCID 166653HydrideHCID 15545851HCID 15545851, compound

Product 1

HCID 15547420HCID 15547420, compound

Sources & evidence

ORD record
ord-25bb067ea8cf4fa0985c81540922190a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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