Methyl Ethyl Ketone → HCID 10073625, compound

HRID 2126774Notes

Reaction equation

HRID 2126774 reaction equation
[CH2:36]([C:37]([CH3:38])=[O:39])[CH3:40].[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]3[c:14]4[c:15]([cH:16]2)[CH2:17][CH2:18][N:13]4[CH:12]2[CH:11]3[CH2:22][NH:21][CH2:20][CH2:19]2)[cH:4][cH:5][cH:6][cH:7]1.[Cl:23][CH2:24][CH2:25][CH2:26][C:27](=[O:28])[c:29]1[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]1>>[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]3[c:14]4[c:15]([cH:16]2)[CH2:17][CH2:18][N:13]4[CH:12]2[CH:11]3[CH2:22][N:21]([CH2:24][CH2:25][CH2:26][C:27](=[O:28])[c:29]3[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]3)[CH2:20][CH2:19]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

4

Sources & evidence

ORD record
ord-c1edd38f47844866bb4edc9e67acbf53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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