Ethanol → HCID 22249963, compound

HRID 1122375Notes

Reaction equation

HRID 1122375 reaction equation
[CH3:36][CH2:37][OH:38].[Cl:1][c:2]1[c:3]([CH2:22][CH2:23][Cl:24])[c:4]([CH3:21])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:20])[c:10]2-[c:11]1[c:12]([CH3:19])[cH:13][c:14]([CH3:18])[cH:15][c:16]1[CH3:17].[NH2:25][C:26]([NH2:27])=[S:28].[Na+:29].[Na+:30].[O-:31][C:32](=[O:33])[O-:34].[OH2:35]>>[c:2]12[c:3]([c:4]([CH3:21])[n:5][c:6]3[n:7]1[n:8][c:9]([CH3:20])[c:10]3-[c:11]1[c:12]([CH3:19])[cH:13][c:14]([CH3:18])[cH:15][c:16]1[CH3:17])[CH2:22][CH2:23][S:28]2

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 2723790ThioureaHCID 22249724HCID 22249724, compound

Product 1

HCID 22249963HCID 22249963, compound

Sources & evidence

ORD record
ord-720a62b80d9b439a9c255b24ee1ec9e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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