1,4-Dioxane → HCID 86629687, compound

HRID 676795Notes

Reaction equation

HRID 676795 reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][O:46][CH2:47]1.[CH:27]1([S:33][c:34]2[cH:35][cH:36][c:37]([CH2:38][NH2:39])[cH:40][cH:41]2)[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]1.[Cl:1][c:2]1[c:3]([O:19][S:20]([C:21]([F:22])([F:23])[F:24])(=[O:25])=[O:26])[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2>>[Cl:1][c:2]1[c:3]([NH:39][CH2:38][c:37]2[cH:36][cH:35][c:34]([S:33][CH:27]3[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]3)[cH:41][cH:40]2)[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 574477477-Chloro-3-(2,2,2-trifluoroacetyl)-6-trifluoromethylsulfonyloxy-2,3,4,5-tetrahydro-1H-benzo[d]azepineHCID 57656337HCID 57656337, compound

Product 1

HCID 86629687HCID 86629687, compound

Sources & evidence

ORD record
ord-1512f8815fa545d59ac44c5ebba45471
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…