Benzene → HCID 53684219, compound

HRID 2348398Notes

Reaction equation

HRID 2348398 reaction equation
[OH2:35].[OH:30][CH2:31][CH:32]([CH3:33])[NH2:34].[c:1]1([S:7](=[O:8])(=[O:9])[NH:10][CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([O:17][CH2:18][C:19](=[O:20])[Cl:21])[cH:22][cH:23]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[c:1]1([S:7](=[O:8])(=[O:9])[NH:10][CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([O:17][CH2:18][C:19](=[O:20])[NH:34][CH:32]([CH2:31][OH:30])[CH3:33])[cH:22][cH:23]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 962WaterHCID 51262-AminopropanolHCID 23470986HCID 23470986, compound

Product 1

HCID 53684219HCID 53684219, compound

Sources & evidence

ORD record
ord-4ffa37140d684a4189bbd804c9f331a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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