Pyridine → HCID 73068617, compound

HRID 1552665Notes

Reaction equation

HRID 1552665 reaction equation
[CH3:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1.[CH3:1][CH2:2][CH:3]([CH2:4][CH3:5])[OH:6].[Cl:62][CH2:63][Cl:64].[Cl:7][C:8]([Cl:9])=[O:10].[F:18][C:19]([c:20]1[cH:21][c:22]([CH2:23][N:24]([CH:25]2[c:26]3[c:27]([cH:32][c:33]([C:37]([F:38])([F:39])[F:40])[c:34]([CH3:36])[cH:35]3)[NH:28][CH2:29][CH2:30][CH2:31]2)[c:41]2[n:42][n:43][n:44]([CH3:46])[n:45]2)[cH:47][c:48]([C:50]([F:51])([F:52])[F:53])[cH:49]1)([F:54])[F:55].[cH:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1>>[CH3:1][CH2:2][CH:3]([CH2:4][CH3:5])[O:6][C:8](=[O:10])[N:28]1[c:27]2[c:26]([cH:35][c:34]([CH3:36])[c:33]([C:37]([F:38])([F:39])[F:40])[cH:32]2)[CH:25]([N:24]([CH2:23][c:22]2[cH:21][c:20]([C:19]([F:18])([F:54])[F:55])[cH:49][c:48]([C:50]([F:51])([F:52])[F:53])[cH:47]2)[c:41]2[n:42][n:43][n:44]([CH3:46])[n:45]2)[CH2:31][CH2:30][CH2:29]1

Participants

7

Reactant 6

HCID 1049PyridineHCID 1140TolueneHCID 6344DichloromethaneHCID 6371PhosgeneHCID 114283-PentanolHCID 72297395N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-methyl-N-(2-methyltetrazol-5-yl)-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-5-amine

Product 1

HCID 73068617HCID 73068617, compound

Sources & evidence

ORD record
ord-9f646922420d405fb5f706d123620838
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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