Acetonitrile → HCID 10480877, compound

HRID 1545149Notes

Reaction equation

HRID 1545149 reaction equation
[CH3:22][S:23][c:24]1[c:25]([NH2:26])[cH:27][cH:28][cH:29][c:30]1[C:31]([F:32])([F:33])[F:34].[CH3:35][C:36]#[N:37].[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][NH:8][C:9](=[O:10])[c:11]2[c:12]([C:18]([F:19])([F:20])[F:21])[n:13][c:14]([Cl:17])[n:15][cH:16]2)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][NH:8][C:9](=[O:10])[c:11]2[c:12]([C:18]([F:19])([F:20])[F:21])[n:13][c:14]([NH:26][c:25]3[c:24]([S:23][CH3:22])[c:30]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:28][cH:27]3)[n:15][cH:16]2)[CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 2781528HCID 2781528, compoundHCID 57982687HCID 57982687, compound

Product 1

HCID 10480877HCID 10480877, compound

Sources & evidence

ORD record
ord-5bfb83c9990a4ea487e74d92946c8339
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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