1-[4-[(4-Fluorophenyl)methyl]phenyl]piperazine → 5-[3-(4-(4-(4-Fluorophenyl)methylphenyl)piperazin-1-yl)propyl]sulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine
Reaction equation
[Cl:1][CH2:2][CH2:3][CH2:4][S:5](=[O:6])(=[O:7])[N:8]1[CH2:9][CH2:10][CH2:11][O:12][c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2.[F:19][c:20]1[cH:21][cH:22][c:23]([CH2:26][c:27]2[cH:28][cH:29][c:30]([N:33]3[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]3)[cH:31][cH:32]2)[cH:24][cH:25]1>>[CH2:2]([CH2:3][CH2:4][S:5](=[O:6])(=[O:7])[N:8]1[CH2:9][CH2:10][CH2:11][O:12][c:13]2[c:14]1[cH:15][cH:16][cH:17][cH:18]2)[N:36]1[CH2:35][CH2:34][N:33]([c:30]2[cH:29][cH:28][c:27]([CH2:26][c:23]3[cH:22][cH:21][c:20]([F:19])[cH:25][cH:24]3)[cH:32][cH:31]2)[CH2:38][CH2:37]1Participants
3
Sources & evidence
- ORD record
- ord-4d9b025b0569454ca5275d31b966ad67
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…