1,2-Dichloroethane → 3-[3-cyano-4-(4-methylimidazol-1-yl)phenyl]-N-[(3-phenylphenyl)methyl]prop-2-enamide

HRID 180857

Reaction equation

HRID 180857 reaction equation
[C:6](#[N:7])[c:8]1[cH:9][c:10]([CH:20]=[CH:21][C:22](=[O:23])[OH:24])[cH:11][cH:12][c:13]1-[n:14]1[cH:15][n:16][c:17]([CH3:19])[cH:18]1.[CH2:50]([Cl:51])[CH2:52][Cl:53].[ClH:25].[O:1]=[CH:2][N:3]([CH3:4])[CH3:5].[OH:40][n:41]1[c:42]2[c:43]([cH:44][cH:45][cH:46][cH:47]2)[n:48][n:49]1.[c:26]1(-[c:32]2[cH:33][c:34]([CH2:35][NH2:36])[cH:37][cH:38][cH:39]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[C:6](#[N:7])[c:8]1[cH:9][c:10]([CH:20]=[CH:21][C:22](=[O:24])[NH:36][CH2:35][c:34]2[cH:33][c:32](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[cH:39][cH:38][cH:37]2)[cH:11][cH:12][c:13]1-[n:14]1[cH:15][n:16][c:17]([CH3:19])[cH:18]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 27603683-(Aminomethyl)biphenylHCID 669601433-[3-Cyano-4-(4-methylimidazol-1-yl)phenyl]prop-2-enoic acid

Product 1

HCID 669612713-[3-cyano-4-(4-methylimidazol-1-yl)phenyl]-N-[(3-phenylphenyl)methyl]prop-2-enamide

Sources & evidence

ORD record
ord-a739cef87a75441f9dc93663d4f24c19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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