Thiophenol → HCID 86644388, compound

HRID 1152137Notes

Reaction equation

HRID 1152137 reaction equation
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[SH:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[c:1]1([NH:7][C:8]([CH:9]=[C:10]([S:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[S:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)=[O:25])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([NH:7][C:8]([CH2:9][CH:10]([S:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[S:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)=[O:25])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 7969ThiophenolHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 86644389HCID 86644389, compound

Product 1

HCID 86644388HCID 86644388, compound

Sources & evidence

ORD record
ord-b6f5d7641ca24551814af67517439de4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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