Ethanol → HCID 86644695, compound

HRID 682174Notes

Reaction equation

HRID 682174 reaction equation
[BH4-:1].[C:5]([CH3:6])(=[O:7])[NH:8][c:9]1[s:10][c:11]2[c:12]([n:13]1)[cH:14][cH:15][c:16]([O:20][c:21]1[cH:22][cH:23][c:24]([F:34])[c:25]([NH:27][C:28](=[O:29])[C:30]([F:31])([F:32])[F:33])[cH:26]1)[c:17]2[C:18]#[N:19].[CH3:35][CH2:36][OH:37].[CH3:3][OH:4].[Na+:2]>>[C:5]([CH3:6])(=[O:7])[NH:8][c:9]1[s:10][c:11]2[c:12]([n:13]1)[cH:14][cH:15][c:16]([O:20][c:21]1[cH:22][cH:23][c:24]([F:34])[c:25]([NH2:27])[cH:26]1)[c:17]2[C:18]#[N:19]

Participants

6

Sources & evidence

ORD record
ord-262515caa0084f499aae11b96fbb4b07
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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