Ethanol → HCID 13606572, compound
Reaction equation
[CH3:24][CH2:25][OH:26].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][N:9]2[C:10](=[O:21])[C:11](=[C:16]3[S:17][CH:18]=[CH:19][S:20]3)[C:12](=[O:15])[CH2:13][CH2:14]2)[cH:22][cH:23]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([CH2:8][N:9]2[C:10](=[O:21])[C:11](=[C:16]3[S:17][CH:18]=[CH:19][S:20]3)[C:12](=[O:15])[CH2:13][CH2:14]2)[cH:22][cH:23]1Participants
3
Sources & evidence
- ORD record
- ord-828bc74ec0424ec7b8a869a6e2fbf17e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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