Ethanol → HCID 12228981, compound

HRID 2126587Notes

Reaction equation

HRID 2126587 reaction equation
[CH3:30][CH2:31][OH:32].[Cl:15][c:16]1[cH:17][cH:18][c:19]([CH2:20][NH2:21])[cH:22][cH:23]1.[Cl:1][c:2]1[n:3][c:4]([S:11][CH2:12][C:13]#[N:14])[n:5][c:6]([CH2:8][CH2:9][CH3:10])[cH:7]1.[Na+:24].[Na+:25].[O-:26][C:27](=[O:28])[O-:29]>>[c:2]1([NH:21][CH2:20][c:19]2[cH:18][cH:17][c:16]([Cl:15])[cH:23][cH:22]2)[n:3][c:4]([S:11][CH2:12][C:13]#[N:14])[n:5][c:6]([CH2:8][CH2:9][CH3:10])[cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 660364-ChlorobenzylamineHCID 12228980Acetonitrile, [(4-chloro-6-propyl-2-pyrimidinyl)thio]-

Product 1

HCID 12228981HCID 12228981, compound

Sources & evidence

ORD record
ord-d57e0a2a021e46b38d5be2309d0b8027
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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