Isopropanol → HCID 67915513, compound
Reaction equation
[CH2:34]([Cl:35])[Cl:36].[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[CH:37]([OH:38])([CH3:39])[CH3:40].[Na:31][C:32]#[N:33].[o:6]1[n:7][c:8]([N:15]2[CH2:16][CH:17]3[N:18]([CH2:19][CH2:20]2)[CH2:21][CH2:22][CH:23]([CH2:25][O:26][S:27]([CH3:28])(=[O:29])=[O:30])[CH2:24]3)[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2>>[o:6]1[n:7][c:8]([N:15]2[CH2:16][CH:17]3[N:18]([CH2:19][CH2:20]2)[CH2:21][CH2:22][CH:23]([CH2:25][C:32]#[N:33])[CH2:24]3)[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2Participants
7
Sources & evidence
- ORD record
- ord-40d86fd679054bf0bcdd28cc5f84271c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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