Benzaldehyde → HCID 20499629, compound

HRID 157837Notes

Reaction equation

HRID 157837 reaction equation
[BrH:25].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH:17](=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[CH:1]1([CH2:4][N:5]([C:6](=[S:7])[NH2:8])[c:9]2[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[CH2:2][CH2:3]1.[OH2:26]>>[CH:1]1([CH2:4][N:5]2[C:6](=[S:7])[NH:8][CH:17]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[c:10]3[c:9]2[cH:14][cH:13][c:12]([O:15][CH3:16])[cH:11]3)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 240BenzaldehydeHCID 260Hydrogen BromideHCID 962WaterHCID 1140TolueneHCID 54541178HCID 54541178, compound

Product 1

HCID 20499629HCID 20499629, compound

Sources & evidence

ORD record
ord-403444c3d49b46afa1b9b387b72aad34
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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