Acetonitrile → HCID 57800261, compound

HRID 1548287Notes

Reaction equation

HRID 1548287 reaction equation
[C:19](=[O:20])([O-:21])[O-:22].[CH2:1]([CH2:2][CH3:3])[c:4]1[nH:5][c:6]2[cH:7][cH:8][c:9]([C:17]#[N:18])[c:10]([C:13]([F:14])([F:15])[F:16])[c:11]2[cH:12]1.[CH3:40][C:41]#[N:42].[Cl:25][CH2:26][c:27]1[n:28][o:29][c:30](-[c:32]2[c:33]([S:38][CH3:39])[n:34][cH:35][cH:36][cH:37]2)[n:31]1.[Cs+:23].[Cs+:24]>>[CH2:1]([CH2:2][CH3:3])[c:4]1[n:5]([CH2:26][c:27]2[n:28][o:29][c:30](-[c:32]3[c:33]([S:38][CH3:39])[n:34][cH:35][cH:36][cH:37]3)[n:31]2)[c:6]2[cH:7][cH:8][c:9]([C:17]#[N:18])[c:10]([C:13]([F:14])([F:15])[F:16])[c:11]2[cH:12]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 27967603-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]-2-(methylsulfanyl)pyridineHCID 674051552-propyl-4-(trifluoromethyl)-1H-indole-5-carbonitrile

Product 1

HCID 57800261HCID 57800261, compound

Sources & evidence

ORD record
ord-789d09ce3998499d87bb6764ec3caf0a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…