Ethanol → HCID 178480156, compound

HRID 171778Notes

Reaction equation

HRID 171778 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9]([CH2:20][CH2:21][CH:22]2[N:23]([CH3:27])[CH2:24][CH2:25][CH2:26]2)[c:10]2[cH:11][c:12]([N+:17]([O-:18])=[O:19])[cH:13][cH:14][c:15]2[cH:16]1.[CH3:29][S:30][C:31](=[NH:32])[c:33]1[s:34][cH:35][cH:36][cH:37]1.[CH3:38][CH2:39][OH:40].[IH:28].[Pd:41]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9]([CH2:20][CH2:21][CH:22]2[N:23]([CH3:27])[CH2:24][CH2:25][CH2:26]2)[c:10]2[cH:11][c:12]([NH:17][C:31](=[NH:32])[c:33]3[s:34][cH:35][cH:36][cH:37]3)[cH:13][cH:14][c:15]2[cH:16]1

Participants

6

Reactant 5

HCID 702EthanolHCID 23938PalladiumHCID 24841Hydrogen iodideHCID 10487134Methyl thiophene-2-carbimidothioateHCID 57474477HCID 57474477, compound

Product 1

HCID 178480156HCID 178480156, compound

Sources & evidence

ORD record
ord-479cb2f9189e4df48a1783c01ed0865b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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