Chloride → HCID 72463278, compound

HRID 1572823Notes

Reaction equation

HRID 1572823 reaction equation
[CH3:42][S:43]([CH3:44])=[O:45].[Cl-:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([c:16]2[cH:17][c:18]([F:29])[cH:19][c:20]([O:22][C:23]([CH:24]([F:25])[F:26])([F:27])[F:28])[cH:21]2)[NH:30][C:31]([NH:32][CH:33]([C:34](=[O:35])[NH2:36])[C:37]([F:38])([F:39])[F:40])=[O:41])[n:6][cH:7]1.[Cl:48][CH2:49][Cl:50].[OH2:47]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([c:16]2[cH:17][c:18]([F:29])[cH:19][c:20]([O:22][C:23]([CH:24]([F:25])[F:26])([F:27])[F:28])[cH:21]2)[NH:30][C:31]([NH:32][CH:33]([C:34]#[N:36])[C:37]([F:38])([F:39])[F:40])=[O:41])[n:6][cH:7]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 679Dimethyl SulfoxideHCID 962WaterHCID 6344DichloromethaneHCID 72463222HCID 72463222, compound

Product 1

HCID 72463278HCID 72463278, compound

Sources & evidence

ORD record
ord-32b0fd6ac0a44eb1a52872f6cba0fc48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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