Benzene → HCID 20566350, compound

HRID 1232080Notes

Reaction equation

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

Participants

Reactant 4

HCID 241Benzene

HCID 3776Isopropanol

HCID 10928Ethyl chloroformate

HCID 3057622Benzenamine, 2-((1,2,4-oxadiazol-3-ylmethyl)thio)-

Product 1

HCID 20566350HCID 20566350, compound

Sources & evidence

ORD record: ord-2ee696e73ebd490a9d6863522c82b70c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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