Tetrahydrofuran → N-{7-cyano-6-[3-({[5-(trifluoromethyl)pyridin-2-yl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide

HRID 281871Notes

Reaction equation

HRID 281871 reaction equation
[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[Cl:1][C:2]([O:3][C:6]([O:4][C:5]([Cl:7])([Cl:8])[Cl:9])=[O:12])([Cl:10])[Cl:11].[F:45][C:46]([c:47]1[cH:48][cH:49][c:50]([NH2:53])[n:51][cH:52]1)([F:54])[F:55].[NH2:13][c:14]1[cH:15][c:16]([O:17][c:18]2[c:19]([C:33]#[N:34])[c:20]3[c:21]([n:22][c:23]([NH:25][C:26](=[O:27])[CH:28]4[CH2:29][CH2:30]4)[s:24]3)[cH:31][cH:32]2)[cH:35][cH:36][cH:37]1.[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1>>[C:6](=[O:12])([NH:13][c:14]1[cH:15][c:16]([O:17][c:18]2[c:19]([C:33]#[N:34])[c:20]3[c:21]([n:22][c:23]([NH:25][C:26](=[O:27])[CH:28]4[CH2:29][CH2:30]4)[s:24]3)[cH:31][cH:32]2)[cH:35][cH:36][cH:37]1)[NH:53][c:50]1[cH:49][cH:48][c:47]([C:46]([F:45])([F:54])[F:55])[cH:52][n:51]1

Participants

7

Reactant 6

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 94429TriphosgeneHCID 7358622-Amino-5-(trifluoromethyl)pyridineHCID 86644685N-[6-(3-aminophenoxy)-7-cyano-1,3-benzothiazol-2-yl]cyclopropanecarboxamide

Product 1

HCID 59454504N-{7-cyano-6-[3-({[5-(trifluoromethyl)pyridin-2-yl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide

Sources & evidence

ORD record
ord-3e6ef48d9a8743eea4e44b9c7bdde0a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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