Sodium ion → 4-(4-Methyl-5-quinolin-6-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-butyraldehyde

HRID 669703Notes

Reaction equation

HRID 669703 reaction equation
[CH3:1][C:2]1([CH3:3])[CH2:6][O:7][CH:5]([CH2:8][CH2:9][CH2:10][S:11][c:12]2[n:13]([CH3:27])[c:14](-[c:17]3[cH:18][c:19]4[cH:20][cH:21][cH:22][n:23][c:24]4[cH:25][cH:26]3)[n:15][n:16]2)[O:4][CH2:28]1.[Na+:34].[Na+:35].[O-:36][C:37](=[O:38])[O-:39].[OH2:40].[S:29](=[O:30])(=[O:31])([OH:32])[OH:33]>>[O:4]=[CH:5][CH2:8][CH2:9][CH2:10][S:11][c:12]1[n:13]([CH3:27])[c:14](-[c:17]2[cH:18][c:19]3[cH:20][cH:21][cH:22][n:23][c:24]3[cH:25][cH:26]2)[n:15][n:16]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 962WaterHCID 1118Sulfuric AcidHCID 19660Carbonate IonHCID 69313151HCID 69313151, compound

Product 1

HCID 865941734-(4-Methyl-5-quinolin-6-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-butyraldehyde

Sources & evidence

ORD record
ord-1ec24e31d9f645e1b97936034fe06446
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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