Bicarbonate Ion → HCID 11235910, compound

HRID 179245Notes

Reaction equation

HRID 179245 reaction equation
[CH3:1][c:2]1[n:3][cH:4][c:5]([S:18](=[O:19])(=[O:20])[c:21]2[cH:22][cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28]2)[c:6]([NH:8][c:9]2[c:10]([CH3:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH3:15])[n:7]1.[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[NH2:29][CH2:30][CH2:31][NH2:32].[Na+:37].[O-:33][C:34]([OH:35])=[O:36]>>[CH3:1][c:2]1[n:3][cH:4][c:5]([S:18](=[O:19])(=[O:20])[c:21]2[cH:22][cH:23][c:24]([C:25]3=[N:29][CH2:30][CH2:31][NH:26]3)[cH:27][cH:28]2)[c:6]([NH:8][c:9]2[c:10]([CH3:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH3:15])[n:7]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 3301EthylenediamineHCID 11749692HCID 11749692, compound

Product 1

HCID 11235910HCID 11235910, compound

Sources & evidence

ORD record
ord-3f0c2b5018b040668653b06949075b96
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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