1,2-Dichloroethane → HCID 23581885, compound

HRID 2328032Notes

Reaction equation

HRID 2328032 reaction equation
[CH2:39]([Cl:40])[CH2:41][Cl:42].[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[NH:26]1[CH2:27][CH:28]2[CH2:29][C:30](=[O:38])[NH:31][c:32]3[cH:33][cH:34][cH:35][c:36]1[c:37]32.[O:1]=[C:2]1[NH:3][c:4]2[n:5][cH:6][cH:7][cH:8][c:9]2[C:10]12[CH2:11][c:12]1[c:13]([cH:14][c:15]3[cH:16][cH:17][c:18]([C:22](=[O:23])[OH:24])[n:19][c:20]3[cH:21]1)[CH2:25]2.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH:43][n:44]1[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[n:51][n:52]1>>[O:1]=[C:2]1[NH:3][c:4]2[n:5][cH:6][cH:7][cH:8][c:9]2[C:10]12[CH2:11][c:12]1[c:13]([cH:14][c:15]3[cH:16][cH:17][c:18]([C:22](=[O:24])[N:26]4[CH2:27][CH:28]5[CH2:29][C:30](=[O:38])[NH:31][c:32]6[cH:33][cH:34][cH:35][c:36]4[c:37]65)[n:19][c:20]3[cH:21]1)[CH2:25]2

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 104421921,2,2a,5-Tetrahydropyrrolo[4,3,2-de]quinolin-4(3H)-oneHCID 59594282HCID 59594282, compound

Product 1

HCID 23581885HCID 23581885, compound

Sources & evidence

ORD record
ord-5500f903e6714a2ea61161f626f57b33
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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