Chloroform → 6-Methyl-1-phenyl-N-{[2-(trifluoromethyl)-2-oxiranyl]methyl}-1H-indazol-4-amine

HRID 142629

Reaction equation

HRID 142629 reaction equation
[Bi:1]([Cl:2])([Cl:3])[Cl:4].[CH3:24][c:25]1[cH:26][c:27]([NH2:40])[c:28]2[cH:29][n:30][n:31](-[c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[c:32]2[cH:33]1.[CH3:5][c:6]1[cH:7][cH:8][c:9]([S:10]([O:11][CH2:16][C:17]2([C:20]([F:21])([F:22])[F:23])[O:18][CH2:19]2)(=[O:12])=[O:13])[cH:14][cH:15]1.[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[CH:57]([Cl:58])([Cl:59])[Cl:60].[Cl:54][CH2:55][Cl:56].[O-:50][C:51](=[O:52])[O-:53].[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1>>[CH2:16]([C:17]1([C:20]([F:21])([F:22])[F:23])[O:18][CH2:19]1)[NH:40][c:27]1[cH:26][c:25]([CH3:24])[cH:33][c:32]2[c:28]1[cH:29][n:30][n:31]2-[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1

Participants

9

Reactant 8

HCID 6212ChloroformHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 24591Bismuth trichlorideHCID 81531DiisopropylethylamineHCID 24809749(2-(Trifluoromethyl)oxiran-2-yl)methyl 4-methylbenzenesulfonateHCID 249380596-Methyl-1-phenyl-1H-indazol-4-amine

Product 1

HCID 249380556-Methyl-1-phenyl-N-{[2-(trifluoromethyl)-2-oxiranyl]methyl}-1H-indazol-4-amine

Sources & evidence

ORD record
ord-fd43417b509b4203860f5f24ba210dc7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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