Dimethyl Sulfoxide → 2-(2,4-Dichlorophenyl-tert.-butyl)-2-(1,2,4-triazol-1-ylmethyl)oxirane

HRID 1563760

Reaction equation

HRID 1563760 reaction equation
[CH3:27][S:28](=[O:29])[CH3:30].[CH3:2][S+:3]([CH3:4])[CH3:5].[Cl:6][c:7]1[c:8]([CH2:14][C:15]([C:16]([CH2:17][n:18]2[n:19][cH:20][n:21][cH:22]2)=[O:23])([CH3:24])[CH3:25])[cH:9][cH:10][c:11]([Cl:13])[cH:12]1.[I-:1].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1.[OH2:26]>>[CH2:2]1[C:16]([C:15]([CH2:14][c:8]2[c:7]([Cl:6])[cH:12][c:11]([Cl:13])[cH:10][cH:9]2)([CH3:24])[CH3:25])([CH2:17][n:18]2[n:19][cH:20][n:21][cH:22]2)[O:23]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 1147TrimethylsulfoniumHCID 8028TetrahydrofuranHCID 30165Iodide IonHCID 133403824-(2,4-Dichlorophenyl)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butanone

Product 1

HCID 133403832-(2,4-Dichlorophenyl-tert.-butyl)-2-(1,2,4-triazol-1-ylmethyl)oxirane

Sources & evidence

ORD record
ord-f90070c90ce447758c58227c83437763
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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