Ethanol → HCID 178429278, compound

HRID 1236392Notes

Reaction equation

HRID 1236392 reaction equation
[Br:36][c:37]1[n:38][n:39]2[c:40]([n:41][c:42](=[O:46])[cH:43][c:44]2[CH3:45])[s:47]1.[CH3:57][CH2:58][OH:59].[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][NH:9][C:10](=[O:11])[CH:12]2[N:13]([S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]3)[CH2:14][CH2:15][NH:16][CH2:17]2)[cH:32][cH:33]1)([F:34])[F:35]>>[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][NH:9][C:10](=[O:11])[CH:12]2[N:13]([S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]3)[CH2:14][CH2:15][N:16]([c:37]3[n:38][n:39]4[c:40]([n:41][c:42](=[O:46])[cH:43][c:44]4[CH3:45])[s:47]3)[CH2:17]2)[cH:32][cH:33]1)([F:34])[F:35]

Participants

5

Reactant 4

HCID 702EthanolHCID 81531DiisopropylethylamineHCID 6373782-bromo-5-methyl-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-oneHCID 72362738N-[[4-(trifluoromethoxy)phenyl]methyl]-1-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine-2-carboxamide

Product 1

HCID 178429278HCID 178429278, compound

Sources & evidence

ORD record
ord-384d86a9231e421ea42f7d8ad032f4dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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