1,2-Dichloroethane → 2-Chloro-N-{3-[4-(3-methyl4-phenoxy-phenylamino)-quinazolin-6-yl]-prop-2-ynyl}-acetamide

HRID 1541109Notes

Reaction equation

HRID 1541109 reaction equation
[C:39]([OH:40])([CH3:41])([CH3:42])[CH3:43].[CH3:20][c:21]1[cH:22][c:23]([NH2:24])[cH:25][cH:26][c:27]1[O:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[Cl:1][CH2:2][C:3](=[O:4])[NH:5][CH2:6][C:7]#[C:8][c:9]1[cH:10][c:11]2[c:12]([Cl:19])[n:13][cH:14][n:15][c:16]2[cH:17][cH:18]1.[Cl:35][CH2:36][CH2:37][Cl:38]>>[Cl:1][CH2:2][C:3](=[O:4])[NH:5][CH2:6][C:7]#[C:8][c:9]1[cH:10][c:11]2[c:12]([NH:24][c:23]3[cH:22][c:21]([CH3:20])[c:27]([O:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[cH:26][cH:25]3)[n:13][cH:14][n:15][c:16]2[cH:17][cH:18]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 6386tert-ButanolHCID 8857Ethyl AcetateHCID 155504883-Methyl-4-phenoxyanilineHCID 224843152-Chloro-N-(3-(4-chloroquinazolin-6-yl)prop-2-yn-1-yl)acetamide

Product 1

HCID 541744332-Chloro-N-{3-[4-(3-methyl4-phenoxy-phenylamino)-quinazolin-6-yl]-prop-2-ynyl}-acetamide

Sources & evidence

ORD record
ord-e1de2788e202436ab98febe1269a7f98
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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