Ethanol → HCID 9885062, compound

HRID 107177Notes

Reaction equation

HRID 107177 reaction equation
[CH3:29][CH2:30][OH:31].[N:1](=[N+:2]=[N-:3])[CH:4]([CH2:5][N:6]1[CH2:7][CH:8]2[CH2:9][N:10]([C:15](=[O:16])[O:17][CH:18]([CH3:19])[CH3:20])[CH2:11][CH:12]([CH2:13]1)[CH2:14]2)[c:21]1[cH:22][cH:23][c:24]([C:27]#[N:28])[cH:25][cH:26]1>>[NH2:1][CH:4]([CH2:5][N:6]1[CH2:7][CH:8]2[CH2:9][N:10]([C:15](=[O:16])[O:17][CH:18]([CH3:19])[CH3:20])[CH2:11][CH:12]([CH2:13]1)[CH2:14]2)[c:21]1[cH:22][cH:23][c:24]([C:27]#[N:28])[cH:25][cH:26]1

Participants

3

Sources & evidence

ORD record
ord-4c5dfd2adea44efcaf2b58f35f297b6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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