Dimethyl Sulfoxide → 1-methyl-isoquinoline-3-carboxylic acid [4-(1H-imidazol-2-ylcarbamoyl)-1H-benzoimidazol-2-yl]-amide
Reaction equation
[CH3:1][c:2]1[n:3][c:4]([C:12](=[O:13])[OH:14])[cH:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12.[CH3:71][S:72]([CH3:73])=[O:74].[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[P-:33]([F:34])([F:35])([F:36])([F:37])([F:38])[F:39].[n:40]1([O:41][C:42]([N:43]([CH3:44])[CH3:45])=[N+:46]([CH3:47])[CH3:48])[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1.[nH:15]1[c:16]([NH:20][C:21](=[O:22])[c:23]2[cH:24][cH:25][cH:26][c:27]3[n:28][c:29]([NH2:32])[nH:30][c:31]23)[n:17][cH:18][cH:19]1>>[CH3:1][c:2]1[n:3][c:4]([C:12](=[O:14])[NH:32][c:29]2[nH:28][c:27]3[cH:26][cH:25][cH:24][c:23]([C:21]([NH:20][c:16]4[n:15][cH:19][cH:18][nH:17]4)=[O:22])[c:31]3[n:30]2)[cH:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-a39127c65a7d4bc6a3da45c4e44425a5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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