1-Butanol → HCID 178504709, compound

HRID 1207965Notes

Reaction equation

HRID 1207965 reaction equation
[CH2:43]([OH:44])[CH2:45][CH2:46][CH3:47].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:22][NH2:23])[c:9](-[c:12]3[c:13]([S:18](=[O:19])(=[O:20])[CH3:21])[cH:14][cH:15][cH:16][cH:17]3)[n:10][c:11]12.[Cl:24][c:25]1[c:26]2[nH:27][cH:28][n:29][c:30]2[n:31][cH:32][n:33]1>>[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:22][NH:23][c:25]3[c:26]4[n:27][cH:28][nH:29][c:30]4[n:31][cH:32][n:33]3)[c:9](-[c:12]3[c:13]([S:18](=[O:19])(=[O:20])[CH3:21])[cH:14][cH:15][cH:16][cH:17]3)[n:10][c:11]12

Participants

5

Reactant 4

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 53592776-ChloropurineHCID 57708006HCID 57708006, compound

Product 1

HCID 178504709HCID 178504709, compound

Sources & evidence

ORD record
ord-0ec80ea7d0474e228cb9ea39071d3eb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…