1-Butanol → HCID 57989777, compound

HRID 1236777Notes

Reaction equation

HRID 1236777 reaction equation
[CH2:48]([OH:49])[CH2:50][CH2:51][CH3:52].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][c:20]([F:35])[c:21]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][cH:31][c:32]4[F:33])[cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1.[NH2:36][CH:37]1[CH2:38][CH2:39][CH:40]([NH:43][S:44](=[O:45])(=[O:46])[CH3:47])[CH2:41][CH2:42]1>>[c:2]1([NH:36][CH:37]2[CH2:38][CH2:39][CH:40]([NH:43][S:44](=[O:45])(=[O:46])[CH3:47])[CH2:41][CH2:42]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][c:20]([F:35])[c:21]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][cH:31][c:32]4[F:33])[cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1

Participants

4

Reactant 3

HCID 2631-ButanolHCID 18348422N-(4-aminocyclohexyl)methanesulfonamideHCID 86636578N-{5-[5-(2-Chloro-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl}-2,6-difluorobenzenesulfonamide

Product 1

HCID 57989777HCID 57989777, compound

Sources & evidence

ORD record
ord-7a03e9d8c75e41cdb4979486151e3c86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…