Chloride → 5-(3,3-Dimethyl-but-1-ynyl)-3-[(1,4-dioxa-spiro[4.5]dec-8-yl)-(4-methyl-cyclohex-3-enecarbonyl)-amino]-thiophene-2-carboxylic acid methyl ester
Reaction equation
[CH3:12][O:13][C:14](=[O:15])[c:16]1[s:17][c:18]([C:32]#[C:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:19][c:20]1[NH:21][CH:22]1[CH2:23][CH2:24][C:25]2([O:26][CH2:27][CH2:28][O:29]2)[CH2:30][CH2:31]1.[CH3:2][C:3]1=[CH:4][CH2:5][CH:6]([C:9](=[O:10])[OH:11])[CH2:7][CH2:8]1.[CH3:38][CH2:39][O:40][C:41]([CH3:42])=[O:43].[Cl-:1].[Cl:44][CH:45]([Cl:46])[CH3:47]>>[CH3:2][C:3]1=[CH:4][CH2:5][CH:6]([C:9](=[O:11])[N:21]([c:20]2[c:16]([C:14]([O:13][CH3:12])=[O:15])[s:17][c:18]([C:32]#[C:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:19]2)[CH:22]2[CH2:23][CH2:24][C:25]3([O:26][CH2:27][CH2:28][O:29]3)[CH2:30][CH2:31]2)[CH2:7][CH2:8]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-3edfd7d02fed4aaaa3172602a7eb147d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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