1,2-Dichloroethane → 4-Fluoro-N-[4-(2-furyl)-5-(tetrahydropyran-4-ylcarbonyl)thiazol-2-yl]benzamide

HRID 671720Notes

Reaction equation

HRID 671720 reaction equation
[CH2:30]([Cl:31])[CH2:32][Cl:33].[ClH:34].[Na+:46].[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH2:14])[s:13]2)[CH2:5][CH2:6]1.[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:35].[OH2:56].[OH:20][C:21](=[O:22])[c:23]1[cH:24][cH:25][c:26]([F:27])[cH:28][cH:29]1.[OH:36][n:37]1[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1.[OH:47][C:48](=[O:49])[O-:50]>>[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH:14][C:21](=[O:20])[c:23]3[cH:24][cH:25][c:26]([F:27])[cH:28][cH:29]3)[s:13]2)[CH2:5][CH2:6]1

Participants

10

Reactant 9

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962Water2×HCID 6228DimethylformamideHCID 99734-Fluorobenzoic AcidHCID 757711-HydroxybenzotriazoleHCID 866124682-Amino-4-(2-furyl)-5-(tetrahydropyran-4-ylcarbonyl)thiazole

Product 1

HCID 231447914-Fluoro-N-[4-(2-furyl)-5-(tetrahydropyran-4-ylcarbonyl)thiazol-2-yl]benzamide

Sources & evidence

ORD record
ord-d40b00cc60a143458651fa7bec209a34
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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