1,2-Dichloroethane → HCID 59374992, compound

HRID 2339428Notes

Reaction equation

HRID 2339428 reaction equation
[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:21]2[c:22]([CH3:36])[c:23]([N:27]3[CH2:28][CH:29]([C:33](=[O:34])[OH:35])[CH2:30][C:31]3=[O:32])[cH:24][cH:25][cH:26]2)[c:8]2[c:9]3[cH:10][cH:11][c:12]([C:17]([CH3:18])([CH3:19])[OH:20])[cH:13][c:14]3[nH:15][c:16]12.[CH2:40]([Cl:41])[CH2:42][Cl:43].[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[CH3:37][NH:38][CH3:39].[Cl:59][CH2:60][Cl:61].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH:44][n:45]1[c:46]2[c:47]([cH:48][cH:49][cH:50][cH:51]2)[n:52][n:53]1>>[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:21]2[c:22]([CH3:36])[c:23]([N:27]3[CH2:28][CH:29]([C:33](=[O:35])[N:38]([CH3:37])[CH3:39])[CH2:30][C:31]3=[O:32])[cH:24][cH:25][cH:26]2)[c:8]2[c:9]3[cH:10][cH:11][c:12]([C:17]([CH3:18])([CH3:19])[OH:20])[cH:13][c:14]3[nH:15][c:16]12

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 674DimethylamineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 757711-HydroxybenzotriazoleHCID 66606451HCID 66606451, compound

Product 1

HCID 59374992HCID 59374992, compound

Sources & evidence

ORD record
ord-9b1f08a5707248b4b8c0a621613bcc5b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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