3-Aminobenzonitrile → HCID 24889092, compound

HRID 2341183Notes

Reaction equation

HRID 2341183 reaction equation
[C:25]([c:26]1[cH:27][c:28]([NH2:32])[cH:29][cH:30][cH:31]1)#[N:33].[CH3:34][O:35][c:36]1[cH:37][c:38](-[c:42]2[c:43]3[c:44]([n:45][c:46]([N:48]4[CH2:49][CH2:50][O:51][CH2:52][CH2:53]4)[n:47]2)[N:54]([c:57]2[cH:58][c:59]([C:60]#[N:61])[cH:62][cH:63][cH:64]2)[CH2:55][CH2:56]3)[cH:39][cH:40][cH:41]1.[Cl:1][c:2]1[c:3]([CH2:4][CH2:5][Cl:6])[c:7](-[c:8]2[cH:9][cH:10][cH:11][c:12]([O:13][CH3:14])[cH:15]2)[n:16][c:17]([N:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[n:24]1>>[OH:35][c:36]1[cH:37][c:38](-[c:42]2[c:43]3[c:44]([n:45][c:46]([N:48]4[CH2:49][CH2:50][O:51][CH2:52][CH2:53]4)[n:47]2)[N:54]([c:57]2[cH:58][c:59]([C:60]#[N:61])[cH:62][cH:63][cH:64]2)[CH2:55][CH2:56]3)[cH:39][cH:40][cH:41]1

Participants

4

Reactant 3

HCID 167023-AminobenzonitrileHCID 592449884-[4-Chloro-5-(2-chloroethyl)-6-(3-methoxyphenyl)-pyrimidin-2-yl]morpholineHCID 67385520HCID 67385520, compound

Product 1

HCID 24889092HCID 24889092, compound

Sources & evidence

ORD record
ord-e7ee54aab0c342c3aceaf2ee7f7ecb13
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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