Dimethyl Sulfoxide → HCID 46917283, compound

HRID 1219535Notes

Reaction equation

[CH3:49][S:50]([CH3:51])=[O:52].[F:1][CH:2]([c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:20]3[CH2:21][CH2:22][N:23]([S:26](=[O:27])(=[O:28])[CH:29]=[CH2:30])[CH2:24][CH2:25]3)[n:11][c:12]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[n:13]1)[cH:31][cH:32][cH:33][c:34]2[O:35][CH3:36])[F:37].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1.[nH:38]1[cH:39][n:40][cH:41][cH:42]1>>[F:1][CH:2]([c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:20]3[CH2:21][CH2:22][N:23]([S:26](=[O:27])(=[O:28])[CH2:29][CH2:30][n:38]4[cH:39][n:40][cH:41][cH:42]4)[CH2:24][CH2:25]3)[n:11][c:12]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[n:13]1)[cH:31][cH:32][cH:33][c:34]2[O:35][CH3:36])[F:37]

Participants

Reactant 4

HCID 679Dimethyl Sulfoxide

HCID 795Imidazole

HCID 1049Pyridine

HCID 469174972-(difluoromethyl)-4-methoxy-1-{4-(4-morpholinyl)-6-[4-(vinylsulfonyl)-1-piperazinyl]-1,3,5-triazin-2-yl}-1H-benzimidazole

Product 1

HCID 46917283HCID 46917283, compound

Sources & evidence

ORD record: ord-202610b02fe94192a99354f16c793ac1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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