Water → HCID 16122795, compound

HRID 174913Notes

Reaction equation

HRID 174913 reaction equation
[C:32](=[O:33])([O-:34])[O-:35].[CH3:16][n:17]1[c:18](-[c:26]2[cH:27][n:28][cH:29][cH:30][cH:31]2)[n:19][n:20][c:21]1[S:22]([CH3:23])(=[O:24])=[O:25].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10]([CH:13]([CH3:14])[OH:15])[n:11][o:12]2)[cH:5][cH:6][cH:7]1.[Cs+:36].[Cs+:37].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:38]>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10]([CH:13]([CH3:14])[O:15][c:21]3[n:17]([CH3:16])[c:18](-[c:26]4[cH:27][n:28][cH:29][cH:30][cH:31]4)[n:19][n:20]3)[n:11][o:12]2)[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 469283343-[5-(Methanesulfonyl)-4-methyl-4H-1,2,4-triazol-3-yl]pyridineHCID 57528604HCID 57528604, compound

Product 1

HCID 16122795HCID 16122795, compound

Sources & evidence

ORD record
ord-e996712995164746bbe7dc4f03a39381
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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