1,4-Dioxane → HCID 18430533, compound

HRID 1565493Notes

Reaction equation

HRID 1565493 reaction equation
[CH2:1]([CH2:2][CH3:3])[N:4]=[C:5]=[O:6].[F:7][c:8]1[cH:9][c:10]2[c:11]([cH:20][c:21]1[NH2:22])[N:12]([CH2:17][C:18]#[CH:19])[C:13](=[O:16])[CH2:14][O:15]2.[O:23]1[CH2:24][CH2:25][O:26][CH2:27][CH2:28]1>>[CH2:1]([CH2:2][CH3:3])[NH:4][C:5](=[O:6])[NH:22][c:21]1[c:8]([F:7])[cH:9][c:10]2[c:11]([cH:20]1)[N:12]([CH2:17][C:18]#[CH:19])[C:13](=[O:16])[CH2:14][O:15]2

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 61033Propyl isocyanateHCID 111603236-amino-7-fluoro-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

Product 1

HCID 18430533HCID 18430533, compound

Sources & evidence

ORD record
ord-861b020e8d1d40a59c9df230147e3671
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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