Bicarbonate Ion → HCID 44210117, compound

HRID 1141644Notes

Reaction equation

HRID 1141644 reaction equation
[C:44](=[O:45])([OH:46])[O-:47].[CH3:1][O:2][C:3](=[O:4])[C:5]1=[C:6]([NH2:27])[NH:7][C:8]([CH3:26])=[C:9]([N+:23](=[O:24])[O-:25])[CH:10]1[c:11]1[c:12]([S:17][CH2:18][CH2:19][CH2:20][CH2:21][Cl:22])[cH:13][cH:14][cH:15][cH:16]1.[CH3:28][O:29][c:30]1[c:31]([N:36]2[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]2)[cH:32][cH:33][cH:34][cH:35]1.[CH:49]([OH:50])([CH3:51])[CH3:52].[I-:43].[Na+:42].[Na+:48]>>[CH3:1][O:2][C:3](=[O:4])[C:5]1=[C:6]([NH2:27])[NH:7][C:8]([CH3:26])=[C:9]([N+:23](=[O:24])[O-:25])[CH:10]1[c:11]1[c:12]([S:17][CH2:18][CH2:19][CH2:20][CH2:21][N:39]2[CH2:38][CH2:37][N:36]([c:31]3[c:30]([O:29][CH3:28])[cH:35][cH:34][cH:33][cH:32]3)[CH2:41][CH2:40]2)[cH:13][cH:14][cH:15][cH:16]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 13461-(2-Methoxyphenyl)piperazineHCID 3776IsopropanolHCID 30165Iodide IonHCID 70074769HCID 70074769, compound

Product 1

HCID 44210117HCID 44210117, compound

Sources & evidence

ORD record
ord-c633a045e435403c931399859e87c043
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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