Acetonitrile → HCID 68908547, compound

HRID 694666Notes

Reaction equation

HRID 694666 reaction equation
[CH2:18]([CH2:19][CH3:20])[O:21][CH:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:28][C:29]#[N:30].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[N:7]([CH2:12][CH:13]([CH2:14][I:15])[CH3:16])[C:8](=[O:11])[CH2:9][O:10]2>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[N:7]([CH2:12][CH:13]([CH2:14][N:25]1[CH2:24][CH2:23][CH:22]([O:21][CH2:18][CH2:19][CH3:20])[CH2:27][CH2:26]1)[CH3:16])[C:8](=[O:11])[CH2:9][O:10]2

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 114920374-PropoxypiperidineHCID 689113056-Fluoro-4-(3-iodo-2-methylpropyl)-1,4-benzoxazin-3-one

Product 1

HCID 68908547HCID 68908547, compound

Sources & evidence

ORD record
ord-5da2f2e6146f4df3a8456227b7beabd9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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