Benzyl Isothiocyanate → 1-Benzyl-3-(7-[2-[4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxymethyl]-1-methyl-1H-benzimidazol-6-yloxy]naphthalen-1-yl)thiourea
Reaction equation
[NH2:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][cH:8][c:9]([O:12][c:13]3[cH:14][cH:15][c:16]4[c:17]([n:18]([CH3:37])[c:19]([CH2:21][O:22][c:23]5[cH:24][cH:25][c:26]([CH2:27][CH:28]6[C:29](=[O:34])[NH:30][C:31](=[O:33])[S:32]6)[cH:35][cH:36]5)[n:20]4)[cH:38]3)[cH:10][c:11]12.[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[S:39]=[C:40]=[N:41][CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][cH:8][c:9]([O:12][c:13]3[cH:14][cH:15][c:16]4[c:17]([n:18]([CH3:37])[c:19]([CH2:21][O:22][c:23]5[cH:24][cH:25][c:26]([CH2:27][CH:28]6[C:29](=[O:34])[NH:30][C:31](=[O:33])[S:32]6)[cH:35][cH:36]5)[n:20]4)[cH:38]3)[cH:10][c:11]12)[C:40](=[S:39])[NH:41][CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-b91e690f8d6344929d1f857ed4c590c8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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