Acetonitrile → HCID 135995049, compound

HRID 2147330Notes

Reaction equation

HRID 2147330 reaction equation
[CH3:29][C:30]#[N:31].[F:1][c:2]1[c:3]([CH2:4][c:5]2[nH:6][c:7](=[O:15])[c:8]([C:13]#[N:14])[c:9]([S:11][CH3:12])[n:10]2)[cH:16][cH:17][cH:18][cH:19]1.[NH:20]1[CH2:21][CH2:22][CH:23]([CH2:26][CH2:27][OH:28])[CH2:24][CH2:25]1>>[F:1][c:2]1[c:3]([CH2:4][c:5]2[nH:6][c:7](=[O:15])[c:8]([C:13]#[N:14])[c:9]([N:20]3[CH2:21][CH2:22][CH:23]([CH2:26][CH2:27][OH:28])[CH2:24][CH2:25]3)[n:10]2)[cH:16][cH:17][cH:18][cH:19]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 739534-PiperidineethanolHCID 58407903HCID 58407903, compound

Product 1

HCID 135995049HCID 135995049, compound

Sources & evidence

ORD record
ord-1559b9deb149462b9c78d14a61d2dc95
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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