1,2-Dichloroethane → N-(3-Formyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydroindazol-1-yl)-acetamide

HRID 168339Notes

Reaction equation

HRID 168339 reaction equation
[CH3:38][C:39](=[O:40])[O-:41].[Cl:42][CH2:43][CH2:44][Cl:45].[Cl:46][CH2:47][Cl:48].[Na+:37].[O:6]=[CH:7][N:8]([CH3:9])[CH3:10].[P:1]([Cl:2])([Cl:3])([Cl:4])=[O:5].[s:11]1[c:12]2[c:13]([cH:14][c:15]1[NH:16][C:17]([CH2:18][n:19]1[n:20][c:21]([C:28]([F:29])([F:30])[F:31])[c:22]3[c:27]1[CH2:26][CH2:25][CH2:24][CH2:23]3)=[O:32])[CH2:33][CH2:34][CH2:35][CH2:36]2>>[O:6]=[CH:7][c:14]1[c:13]2[c:12]([s:11][c:15]1[NH:16][C:17]([CH2:18][n:19]1[n:20][c:21]([C:28]([F:29])([F:30])[F:31])[c:22]3[c:27]1[CH2:26][CH2:25][CH2:24][CH2:23]3)=[O:32])[CH2:36][CH2:35][CH2:34][CH2:33]2

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 175AcetateHCID 923Sodium ionHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 24813Phosphorus oxychlorideHCID 59520488N-(4,5,6,7-Tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydro indazol-1-yl)-acetamide

Product 1

HCID 59520503N-(3-Formyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydroindazol-1-yl)-acetamide

Sources & evidence

ORD record
ord-80fd423aef024a43a74cbfd8580a7319
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…