4-Fluorobenzonitrile → Letrozole

HRID 211832

Reaction equation

HRID 211832 reaction equation
[F:15][c:16]1[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]1.[n:1]1([CH2:6][c:7]2[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]2)[n:2][cH:3][n:4][cH:5]1>>[n:1]1([CH:6]([c:7]2[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]2)[c:16]2[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]2)[n:2][cH:3][n:4][cH:5]1

Participants

3

Reactant 2

HCID 145174-FluorobenzonitrileHCID 75376164-(1,2,4-Triazol-1-ylmethyl)benzonitrile

Product 1

HCID 3902Letrozole

Sources & evidence

ORD record
ord-af3ce0adcb004695bc8af5e9878bef98
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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