Acetonitrile → HCID 25061105, compound

HRID 1118342Notes

Reaction equation

HRID 1118342 reaction equation
[CH3:43][C:44]#[N:45].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[CH2:8][CH2:9][N:10]([c:12]1[c:13]([C:14]#[N:15])[cH:16][c:17]([CH3:20])[cH:18][cH:19]1)[CH2:11]2.[n:21]1[cH:22][cH:23][n:24][c:25]2[cH:26][c:27]([CH:31]([CH3:32])[NH2:33])[cH:28][cH:29][c:30]12>>[c:2]1([NH:33][CH:31]([c:27]2[cH:26][c:25]3[n:24][cH:23][cH:22][n:21][c:30]3[cH:29][cH:28]2)[CH3:32])[c:3]2[c:4]([n:5][cH:6][n:7]1)[CH2:8][CH2:9][N:10]([c:12]1[c:13]([C:14]#[N:15])[cH:16][c:17]([CH3:20])[cH:18][cH:19]1)[CH2:11]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 81531DiisopropylethylamineHCID 49761711HCID 49761711, compoundHCID 598406882-(4-Chloro-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-5-methylbenzonitrile

Product 1

HCID 25061105HCID 25061105, compound

Sources & evidence

ORD record
ord-1649d96badb446d99717b31b05ff5a3f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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