Sodium ion → HCID 25028369, compound

HRID 1130758Notes

Reaction equation

HRID 1130758 reaction equation
[I-:30].[Na+:29].[O:31]=[C:32]=[N:33][CH:34]1[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]1.[c:1]1([S:7](=[O:8])(=[O:9])[N:10]2[CH:11]([C:13](=[O:14])[N:15]3[CH2:16][CH2:17][N:18]([c:21]4[c:22]([CH3:28])[cH:23][cH:24][c:25]([CH3:27])[cH:26]4)[CH2:19][CH2:20]3)[CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[N:10]2[CH2:12][CH:11]([C:13](=[O:14])[N:15]3[CH2:16][CH2:17][N:18]([c:21]4[c:22]([CH3:28])[cH:23][cH:24][c:25]([CH3:27])[cH:26]4)[CH2:19][CH2:20]3)[N:33]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[C:32]2=[O:31])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 18502Cyclohexyl isocyanateHCID 30165Iodide IonHCID 86623480((R)-1-benzenesulfonyl-aziridin-2-yl)-[4-(2,5-dimethyl-phenyl)-piperazin-1-yl]-methanone

Product 1

HCID 25028369HCID 25028369, compound

Sources & evidence

ORD record
ord-fb71ab578f6042aba54796b55b24712f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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