Dimethyl Sulfoxide → HCID 178492431, compound

HRID 1567342Notes

Reaction equation

HRID 1567342 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([O:41][CH3:42])[c:6]([NH:9][C:10](=[O:11])[CH:12]2[CH:13]([c:33]3[c:34]([F:40])[c:35]([Cl:39])[cH:36][cH:37][cH:38]3)[C:14]3([C:15](=[O:25])[NH:16][c:17]4[c:18]([F:24])[c:19]([Cl:23])[cH:20][cH:21][c:22]43)[CH:26]([CH2:28][C:29]([CH3:30])([CH3:31])[CH3:32])[NH:27]2)[cH:7][cH:8]1.[CH3:47][S:48]([CH3:49])=[O:50].[Na+:46].[OH-:45].[OH:43][OH:44]>>[C:1]([NH2:2])([c:3]1[cH:4][c:5]([O:41][CH3:42])[c:6]([NH:9][C:10](=[O:11])[CH:12]2[CH:13]([c:33]3[c:34]([F:40])[c:35]([Cl:39])[cH:36][cH:37][cH:38]3)[C:14]3([C:15](=[O:25])[NH:16][c:17]4[c:18]([F:24])[c:19]([Cl:23])[cH:20][cH:21][c:22]43)[CH:26]([CH2:28][C:29]([CH3:30])([CH3:31])[CH3:32])[NH:27]2)[cH:7][cH:8]1)=[O:43]

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 784Hydrogen PeroxideHCID 923Sodium ionHCID 961HydroxideHCID 76741114rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-7-fluoro-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (4-cyano-2-methoxy-phenyl)-amide

Product 1

HCID 178492431HCID 178492431, compound

Sources & evidence

ORD record
ord-58e7a8e7646a4776a923cacd01732952
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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