Chloride → N-(4-Methyl-3-{1-methyl-2-oxo-7-[(pyridin-3-ylmethyl)-amino]-1,2-dihydro-[1,6]naphthyridin-3-yl}-phenyl)-3-trifluoromethyl-benzamide

HRID 1216158Notes

Reaction equation

HRID 1216158 reaction equation
[CH2:72]1[O:73][CH2:74][CH2:75][O:76][CH2:77]1.[CH:43]([c:44]1[cH:45][cH:46][cH:47][c:48]([CH:49]([CH3:50])[CH3:51])[c:52]1-[n+:53]1[cH:54][cH:55][n:56](-[c:57]2[c:58]([CH:59]([CH3:60])[CH3:61])[cH:62][cH:63][cH:64][c:65]2[CH:66]([CH3:67])[CH3:68])[cH:69]1)([CH3:70])[CH3:71].[Cl-:42].[Cl:1][c:2]1[n:3][cH:4][c:5]2[cH:6][c:7](-[c:14]3[cH:15][c:16]([NH:21][C:22]([c:23]4[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]4)=[O:33])[cH:17][cH:18][c:19]3[CH3:20])[c:8](=[O:13])[n:9]([CH3:12])[c:10]2[cH:11]1.[NH2:34][CH2:35][c:36]1[cH:37][n:38][cH:39][cH:40][cH:41]1>>[c:2]1([NH:34][CH2:35][c:36]2[cH:37][n:38][cH:39][cH:40][cH:41]2)[n:3][cH:4][c:5]2[cH:6][c:7](-[c:14]3[cH:15][c:16]([NH:21][C:22]([c:23]4[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]4)=[O:33])[cH:17][cH:18][c:19]3[CH3:20])[c:8](=[O:13])[n:9]([CH3:12])[c:10]2[cH:11]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 310183-PyridinemethanamineHCID 312751,4-DioxaneHCID 27349141,3-Bis[2,6-di(propan-2-yl)phenyl]imidazol-1-iumHCID 59833848Benzamide,n-[3-(7-chloro-1,2-dihydro-1-methyl-2-oxo-1,6-naphthyridin-3-yl)-4-methylphenyl]-3-(trifluoromethyl)-

Product 1

HCID 59833940N-(4-Methyl-3-{1-methyl-2-oxo-7-[(pyridin-3-ylmethyl)-amino]-1,2-dihydro-[1,6]naphthyridin-3-yl}-phenyl)-3-trifluoromethyl-benzamide

Sources & evidence

ORD record
ord-ff36d5ecc448492a85a6c25cf6f6793c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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