1,2-Dichloroethane → 17-[2-(6-Methylpyridin-2-yl)-7-methoxy-8-methyl-quinolin-4-yloxy]-13-methyl-2,14-dioxo-3,13-diaza-tricyclo-[13.3.0.04,6]octadec-7-ene-4-carboxylic acid ethyl ester

HRID 1554111Notes

Reaction equation

HRID 1554111 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([NH:11][C:12](=[O:13])[CH:14]2[CH:15]([C:40]([N:41]([CH3:42])[CH2:43][CH2:44][CH2:45][CH2:46][CH:47]=[CH2:48])=[O:49])[CH2:16][CH:17]([O:19][c:20]3[cH:21][c:22](-[c:33]4[n:34][c:35]([CH3:39])[cH:36][cH:37][cH:38]4)[n:23][c:24]4[c:25]([CH3:32])[c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]34)[CH2:18]2)[CH:7]([CH:9]=[CH2:10])[CH2:8]1.[Cl:50][CH2:51][CH2:52][Cl:53]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]12[CH:7]([CH2:8]1)[CH:9]=[CH:10][CH2:46][CH2:45][CH2:44][CH2:43][N:41]([CH3:42])[C:40](=[O:49])[CH:15]1[CH:14]([C:12](=[O:13])[NH:11]2)[CH2:18][CH:17]([O:19][c:20]2[cH:21][c:22](-[c:33]3[n:34][c:35]([CH3:39])[cH:36][cH:37][cH:38]3)[n:23][c:24]3[c:25]([CH3:32])[c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]23)[CH2:16]1

Participants

3

Reactant 2

HCID 111,2-DichloroethaneHCID 668720481-{2-(Hex-5-enylmethylcarbamoyl)-4-[2-(6-methyl-2-pyridyl)-7-methoxy-8-methylquinolin-4-yloxy]cyclopentanecarbonyl}amino-2-vinylcyclopropanecarboxylic acid ethyl ester

Product 1

HCID 6687158517-[2-(6-Methylpyridin-2-yl)-7-methoxy-8-methyl-quinolin-4-yloxy]-13-methyl-2,14-dioxo-3,13-diaza-tricyclo-[13.3.0.04,6]octadec-7-ene-4-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-81ffb0fac31d43bcb3b4169b2e80c6f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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