Dimethyl Sulfoxide → HCID 9996198, compound
Reaction equation
[CH3:33][S:34]([CH3:35])=[O:36].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[Cl:1][c:2]1[n:3][o:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2.[K+:26].[K+:27].[NH2:11][CH2:12][CH:13]1[CH2:14][CH2:15][N:16]([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:17][CH2:18]1.[O-:28][C:29]([O-:30])=[O:31].[OH2:32]>>[c:2]1([NH:11][CH2:12][CH:13]2[CH2:14][CH2:15][N:16]([CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:17][CH2:18]2)[n:3][o:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2Participants
8
Sources & evidence
- ORD record
- ord-2612c072ba924a2cba71651fee720bfc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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