2-Methyl-3-butyn-2-ol → HCID 58204123, compound

HRID 285688Notes

Reaction equation

HRID 285688 reaction equation
[CH3:29][C:30]([CH3:31])([C:32]#[CH:33])[OH:34].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:28]1)-[c:7]1[s:8][c:9](-[c:15]3[n:16](-[c:20]4[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]4)[n:17][cH:18][n:19]3)[cH:10][c:11]1[CH2:12][CH2:13][O:14]2>>[c:2]1([CH2:33][CH2:32][C:30]([CH3:29])([CH3:31])[OH:34])[cH:3][cH:4][c:5]2[c:6]([n:28]1)-[c:7]1[s:8][c:9](-[c:15]3[n:16](-[c:20]4[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]4)[n:17][cH:18][n:19]3)[cH:10][c:11]1[CH2:12][CH2:13][O:14]2

Participants

3

Reactant 2

HCID 82582-Methyl-3-butyn-2-olHCID 579003099-Chloro-2-[2-(2,4-difluoro-phenyl)-2H-[1,2,4]triazol-3-yl]-4,5-dihydro-6-oxa-1-thia-10-aza-benzo[e]azulene

Product 1

HCID 58204123HCID 58204123, compound

Sources & evidence

ORD record
ord-0b23fa85a7644801adb5a36fdf507aac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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