Dichloromethane → 4-(3-chloro-4-(N-(4-chlorobenzenesulphonyl)-N-methylaminomethyl)thiophene-2-carbonyl)-N-(3-methyl-1,2,4-oxadiazol-5-ylmethyl)benzomorpholine-2-carboxamide

HRID 301702

Reaction equation

HRID 301702 reaction equation
[CH3:23][c:24]1[n:25][o:26][c:27]([CH2:29][NH:30][C:31](=[O:32])[CH:33]2[O:34][c:35]3[c:36]([cH:39][cH:40][cH:41][cH:42]3)[NH:37][CH2:38]2)[n:28]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[Cl:1][c:2]1[c:3]([C:20](=[O:21])[OH:22])[s:4][cH:5][c:6]1[CH2:7][N:8]([CH3:9])[S:10](=[O:11])(=[O:12])[c:13]1[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]1.[Cl:60][CH2:61][Cl:62].[S:56]([Cl:57])([Cl:58])=[O:59]>>[Cl:1][c:2]1[c:3]([C:20](=[O:22])[N:37]2[c:36]3[c:35]([cH:42][cH:41][cH:40][cH:39]3)[O:34][CH:33]([C:31]([NH:30][CH2:29][c:27]3[o:26][n:25][c:24]([CH3:23])[n:28]3)=[O:32])[CH2:38]2)[s:4][cH:5][c:6]1[CH2:7][N:8]([CH3:9])[S:10](=[O:11])(=[O:12])[c:13]1[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 24386Thionyl ChlorideHCID 59700600N-(3-methyl-1,2,4-oxadiazol-5-ylmethyl)benzomorpholine-2-carboxamideHCID 692074073-chloro-4-(N-(4-chlorobenzenesulphonyl)-N-methylaminomethyl)thiophene-2-carboxylic acid

Product 1

HCID 248847834-(3-chloro-4-(N-(4-chlorobenzenesulphonyl)-N-methylaminomethyl)thiophene-2-carbonyl)-N-(3-methyl-1,2,4-oxadiazol-5-ylmethyl)benzomorpholine-2-carboxamide

Sources & evidence

ORD record
ord-9666262b0b974eeea07bd2abc412d0b5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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