Bicarbonate Ion → HCID 59507055, compound

HRID 202344Notes

Reaction equation

HRID 202344 reaction equation
[C:45](=[O:46])([O-:47])[OH:48].[CH2:37]([CH3:38])[N:39]1[CH2:40][CH2:41][NH:42][CH2:43][CH2:44]1.[Cl:1][CH2:2][C:3](=[O:4])[NH:5][c:6]1[s:7][c:8]2[n:9][c:10]([O:15][c:16]3[cH:17][c:18]([NH:23][C:24]([c:25]4[cH:26][c:27]([C:31]([CH3:32])([CH3:33])[C:34]#[N:35])[cH:28][cH:29][cH:30]4)=[O:36])[cH:19][cH:20][c:21]3[CH3:22])[cH:11][cH:12][c:13]2[n:14]1.[Na+:49].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1>>[CH2:2]([C:3](=[O:4])[NH:5][c:6]1[s:7][c:8]2[n:9][c:10]([O:15][c:16]3[cH:17][c:18]([NH:23][C:24]([c:25]4[cH:26][c:27]([C:31]([CH3:32])([CH3:33])[C:34]#[N:35])[cH:28][cH:29][cH:30]4)=[O:36])[cH:19][cH:20][c:21]3[CH3:22])[cH:11][cH:12][c:13]2[n:14]1)[N:42]1[CH2:41][CH2:40][N:39]([CH2:37][CH3:38])[CH2:44][CH2:43]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 791961-EthylpiperazineHCID 86646041HCID 86646041, compound

Product 1

HCID 59507055HCID 59507055, compound

Sources & evidence

ORD record
ord-a95c6e7c0dcb4a83ab490e6c1dcbb280
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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