(2-Methylphenyl)methanethiol → HCID 178424300, compound
Reaction equation
[CH3:10][S:11]([O:12][CH:15]1[C:16]2([CH3:17])[CH:18]([CH2:19][CH2:20]1)[CH:21]1[CH2:22][CH2:23][C:24]3=[CH:25][C:26](=[O:35])[CH:27]=[CH:28][C:29]3([CH3:30])[CH:31]1[C:32](=[O:34])[CH2:33]2)(=[O:13])=[O:14].[CH3:1][c:2]1[c:3]([CH2:4][SH:5])[cH:6][cH:7][cH:8][cH:9]1>>[CH3:1][c:2]1[c:3]([CH2:4][S:5][CH:15]2[C:16]3([CH3:17])[CH:18]([CH2:19][CH2:20]2)[CH:21]2[CH2:22][CH2:23][C:24]4=[CH:25][C:26](=[O:35])[CH:27]=[CH:28][C:29]4([CH3:30])[CH:31]2[C:32](=[O:34])[CH2:33]3)[cH:6][cH:7][cH:8][cH:9]1Participants
3
Sources & evidence
- ORD record
- ord-6e60eeeeca37425499c37c5af6a76de4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…