Toluene → 1H-Benzo[D]imidazole-2-YL(4-(3-(tetrahydro-2H-thiopyran-4-YL)pyrazin-2-yloxy)phenyl)methanone

HRID 196658

Reaction equation

HRID 196658 reaction equation
[CH2:80]1[O:81][CH2:82][CH2:83][CH2:84]1.[CH3:40][O:41][N:42]([C:43]([c:44]1[cH:45][cH:46][c:47]([O:50][c:51]2[n:52][cH:53][cH:54][n:55][c:56]2[CH:57]2[CH2:58][CH2:59][S:60][CH2:61][CH2:62]2)[cH:48][cH:49]1)=[O:63])[CH3:64].[CH3:66][CH:67]([N-:68][CH:69]([CH3:70])[CH3:71])[CH3:72].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[CH:10]([O:11][CH:12]([O:13][CH:14]([CH3:15])[CH3:16])[O:17][CH:18]([CH3:19])[CH3:20])([CH3:21])[CH3:22].[CH:33]([NH:34][CH:35]([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Li+:65].[c:23]1([S:24]([OH:25])(=[O:26])=[O:27])[cH:28][cH:29][cH:30][cH:31][cH:32]1.[nH:1]1[cH:2][n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[nH:1]1[c:2]([C:43]([c:44]2[cH:45][cH:46][c:47]([O:50][c:51]3[n:52][cH:53][cH:54][n:55][c:56]3[CH:57]3[CH2:58][CH2:59][S:60][CH2:61][CH2:62]3)[cH:48][cH:49]2)=[O:63])[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2

Participants

10

Reactant 9

HCID 1140TolueneHCID 5798BenzimidazoleHCID 7371Benzenesulfonic AcidHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 78191Propane, 2,2',2''-[methylidynetris(oxy)]tris-HCID 5062348DiisopropylamideHCID 59351159N-Methoxy-N-methyl-4-(3-(tetrahydro-2H-thiopyran-4-YL)pyrazin-2-yloxy)benzamide

Product 1

HCID 593511281H-Benzo[D]imidazole-2-YL(4-(3-(tetrahydro-2H-thiopyran-4-YL)pyrazin-2-yloxy)phenyl)methanone

Sources & evidence

ORD record
ord-e1ece04eac3f4bffaedaf5678a51ddc8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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