5-(5-[(3-chloropropyl)thio]-4-methyl-4H-1,2,4-triazol-3-yl)-2-methylquinoline → Hydrochloric Acid
Reaction equation
[CH2:1]([CH3:2])[c:3]1[o:4][c:5]2[c:6]([CH3:17])[c:7]3[c:8]([cH:14][c:15]2[n:16]1)[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]3.[Cl:18][CH2:19][CH2:20][CH2:21][S:22][c:23]1[n:24]([CH3:39])[c:25](-[c:28]2[c:29]3[cH:30][cH:31][c:32]([CH3:38])[n:33][c:34]3[cH:35][cH:36][cH:37]2)[n:26][n:27]1>>[CH2:1]([CH3:2])[c:3]1[o:4][c:5]2[c:6]([CH3:17])[c:7]3[c:8]([cH:14][c:15]2[n:16]1)[CH2:9][CH2:10][N:11]([CH2:19][CH2:20][CH2:21][S:22][c:23]1[n:24]([CH3:39])[c:25](-[c:28]2[c:29]4[cH:30][cH:31][c:32]([CH3:38])[n:33][c:34]4[cH:35][cH:36][cH:37]2)[n:26][n:27]1)[CH2:12][CH2:13]3.[ClH:18]Participants
4
Sources & evidence
- ORD record
- ord-30df2d7780284c21b82937196541ce89
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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