Hydrochloric Acid → 6-[3-Pentyl-3-(5,5,8,8-Tetramethyl-5,6,7,8-Tetrahydro-Naphthalen-2-yl)-Ureido]-Nicotinic Acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[N:6]([C:7]([NH:8][c:9]1[n:10][cH:11][c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18]1)=[O:19])[c:20]1[cH:21][c:22]2[c:27]([cH:28][cH:29]1)[C:26]([CH3:30])([CH3:31])[CH2:25][CH2:24][C:23]2([CH3:32])[CH3:33].[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:43][OH:44].[ClH:37].[Li+:36].[OH-:35].[OH2:34].[OH2:45]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[N:6]([C:7]([NH:8][c:9]1[n:10][cH:11][c:12]([C:13](=[O:14])[OH:15])[cH:17][cH:18]1)=[O:19])[c:20]1[cH:21][c:22]2[c:27]([cH:28][cH:29]1)[C:26]([CH3:30])([CH3:31])[CH2:25][CH2:24][C:23]2([CH3:32])[CH3:33]Participants
8
Sources & evidence
- ORD record
- ord-e11f65efe41a44ae908c804251748768
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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