1,2-Dichloroethane → HCID 59487297, compound

HRID 1223635Notes

Reaction equation

HRID 1223635 reaction equation
[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[Cl:53][CH2:54][Cl:55].[ClH:5].[F:33][c:34]1[cH:35][cH:36][c:37]([CH2:40][CH2:41][CH2:42][S:43][c:44]2[c:45]([C:46](=[O:47])[OH:48])[cH:49][cH:50][cH:51][n:52]2)[cH:38][cH:39]1.[OH:6][n:7]1[c:8]2[c:9]([cH:10][cH:11][cH:12][cH:13]2)[n:14][n:15]1.[n:25]1[c:26]([CH2:31][NH2:32])[cH:27][cH:28][cH:29][cH:30]1>>[n:25]1[c:26]([CH2:31][NH:32][C:46]([c:45]2[c:44]([S:43][CH2:42][CH2:41][CH2:40][c:37]3[cH:36][cH:35][c:34]([F:33])[cH:39][cH:38]3)[n:52][cH:51][cH:50][cH:49]2)=[O:47])[cH:27][cH:28][cH:29][cH:30]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 195092-PyridinemethanamineHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 67133585HCID 67133585, compound

Product 1

HCID 59487297HCID 59487297, compound

Sources & evidence

ORD record
ord-7b6bb5adc0bd462bb187491236f039f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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