2-[6-(aminocarbonyl)-3,4-dihydro-1H-2-benzopyran-1-yl]ethyl methanesulfonate → HCID 178429841, compound
Reaction equation
[CH3:20][S:21]([O:22][CH2:25][CH2:26][CH:27]1[O:28][CH2:29][CH2:30][c:31]2[c:32]1[cH:33][cH:34][c:35]([C:37](=[O:38])[NH2:39])[cH:36]2)(=[O:23])=[O:24].[CH:1]1=[CH:2][c:3]2[cH:4][cH:5][c:6]([N:13]3[CH2:14][CH:15]([CH3:19])[NH:16][CH2:17][CH2:18]3)[c:7]3[cH:8][cH:9][cH:10][c:11]1[c:12]23>>[CH:1]1=[CH:2][c:3]2[cH:4][cH:5][c:6]([N:13]3[CH2:14][CH:15]([CH3:19])[N:16]([CH2:25][CH2:26][CH:27]4[O:28][CH2:29][CH2:30][c:31]5[c:32]4[cH:33][cH:34][c:35]([C:37](=[O:38])[NH2:39])[cH:36]5)[CH2:17][CH2:18]3)[c:7]3[cH:8][cH:9][cH:10][c:11]1[c:12]23Participants
3
Sources & evidence
- ORD record
- ord-d9d640e0b84b451cbdf0fb077172c77a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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