1-Cyanocyclopropanecarboxylic acid → HCID 72404086, compound

HRID 2314517Notes

Reaction equation

HRID 2314517 reaction equation
[C:1](#[N:2])[C:3]1([C:6](=[O:7])[OH:8])[CH2:4][CH2:5]1.[C:9]([c:10]1[nH:11][cH:12][cH:13][n:14]1)([c:15]1[nH:16][cH:17][cH:18][n:19]1)=[O:20].[CH3:21][c:22]1[n:23][c:24]2[c:25]([n:26]1[CH:27]1[CH2:28][CH:29]3[CH2:30][CH2:31][CH:32]([CH2:33]1)[N:34]3[CH2:35][CH2:36][C:37]1([c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1)[cH:49][cH:50][cH:51][cH:52]2>>[C:1](#[N:2])[C:3]1([C:6](=[O:8])[N:40]2[CH2:39][CH2:38][C:37]([CH2:36][CH2:35][N:34]3[CH:29]4[CH2:28][CH:27]([n:26]5[c:22]([CH3:21])[n:23][c:24]6[c:25]5[cH:49][cH:50][cH:51][cH:52]6)[CH2:33][CH:32]3[CH2:31][CH2:30]4)([c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[CH2:42][CH2:41]2)[CH2:4][CH2:5]1

Participants

4

Reactant 3

HCID 27332591-Cyanocyclopropanecarboxylic acidHCID 5250894Bis-(1H-imidazol-2-YL)-methanoneHCID 587278272-Methyl-1-{8-[2-(4-phenyl-4-piperidinyl)ethyl]-8-azabicyclo[3.2.1]oct-3-yl}-1H-benzimidazole

Product 1

HCID 72404086HCID 72404086, compound

Sources & evidence

ORD record
ord-6a297a57c274421497103e5f227d54dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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