Ethanol → HCID 68871059, compound
Reaction equation
[CH3:25][CH2:26][OH:27].[Cl:1][c:2]1[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH:11]([CH3:12])[CH3:13])[cH:6][cH:7]1.[NH2:17][CH2:18][CH2:19][N:20]1[CH2:21][CH2:22][CH2:23][CH2:24]1>>[c:2]1([NH:17][CH2:18][CH2:19][N:20]2[CH2:21][CH2:22][CH2:23][CH2:24]2)[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH:11]([CH3:12])[CH3:13])[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-267a74add6fa4e59bb40bf7c6c9278cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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