Sodium ion → 4-phenyl-1-(N-trifluoroacetylindoline-5-sulfonyl)-2-imidazolone

HRID 1117999Notes

Reaction equation

HRID 1117999 reaction equation
[CH3:13][N:14]([CH3:15])[CH:16]=[O:17].[F:20][C:21]([C:22](=[O:23])[N:24]1[CH2:25][CH2:26][c:27]2[cH:28][c:29]([S:33](=[O:34])(=[O:35])[Cl:36])[cH:30][cH:31][c:32]21)([F:37])[F:38].[H-:18].[Na+:19].[OH2:39].[c:1]1(-[c:7]2[nH:8][c:9](=[O:12])[nH:10][cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[nH:8][c:9](=[O:12])[n:10]([S:33]([c:29]3[cH:28][c:27]4[c:32]([cH:31][cH:30]3)[N:24]([C:22]([C:21]([F:20])([F:37])[F:38])=[O:23])[CH2:25][CH2:26]4)(=[O:34])=[O:35])[cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 110626774-phenyl-2,3-dihydro-1H-imidazol-2-oneHCID 110883061-(Trifluoroacetyl)-2,3-dihydro-1H-indole-5-sulfonyl chloride

Product 1

HCID 212248744-phenyl-1-(N-trifluoroacetylindoline-5-sulfonyl)-2-imidazolone

Sources & evidence

ORD record
ord-25926ba51a5d40d0a8ce8760d7823640
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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