Hydrochloric Acid → methyl 4-[(4-methoxyphenyl)methylsulfanyl]-3-[(7-nitro-2-phenyl-1H-indole-5-carbonyl)amino]butanoate
Reaction equation
[CH3:23][O:24][C:25]([CH2:26][CH:27]([CH2:28][S:29][CH2:30][c:31]1[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]1)[NH2:39])=[O:40].[ClH:22].[c:1]1(-[c:7]2[nH:8][c:9]3[c:10]([N+:19](=[O:20])[O-:21])[cH:11][c:12]([C:16](=[O:17])[OH:18])[cH:13][c:14]3[cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[nH:8][c:9]3[c:10]([N+:19](=[O:20])[O-:21])[cH:11][c:12]([C:16](=[O:17])[NH:39][CH:27]([CH2:26][C:25]([O:24][CH3:23])=[O:40])[CH2:28][S:29][CH2:30][c:31]4[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]4)[cH:13][c:14]3[cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-514a14eb99a14fea9b72fb956bc12f60
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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