Hydrochloric Acid → 1-[3-(1-tert-Butoxycarbonylpiperidin-4-yl]propionyl]-4-[(6-chloronaphthalen-2-yl)sulfonyl]piperazine
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][CH2:15][C:16](=[O:17])[OH:18])[CH2:12][CH2:13]1.[Cl:20][c:21]1[cH:22][c:23]2[cH:24][cH:25][c:26]([S:31](=[O:32])(=[O:33])[N:34]3[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]3)[cH:27][c:28]2[cH:29][cH:30]1.[ClH:19]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][CH2:15][C:16](=[O:18])[N:37]2[CH2:36][CH2:35][N:34]([S:31]([c:26]3[cH:25][cH:24][c:23]4[cH:22][c:21]([Cl:20])[cH:30][cH:29][c:28]4[cH:27]3)(=[O:32])=[O:33])[CH2:39][CH2:38]2)[CH2:12][CH2:13]1Participants
4
Sources & evidence
- ORD record
- ord-405932e66e734cf493d53f122c0d6feb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)