Acetonitrile → HCID 69655543, compound

HRID 167139Notes

Reaction equation

HRID 167139 reaction equation
[Br:21][CH2:22][c:23]1[cH:24][cH:25][c:26]([C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]1.[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][C:40]#[N:41].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]2[CH:13]([C:18](=[O:19])[NH2:20])[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][cH:7]1.[Cs+:37].[Cs+:38]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH:12]2[CH:13]([C:18](=[O:19])[NH2:20])[CH2:14][CH2:15][CH2:16][CH2:17]2)[CH2:22][c:23]2[cH:24][cH:25][c:26]([C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 256687Methyl 4-(bromomethyl)benzoateHCID 696562512-[(4-Chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide

Product 1

HCID 69655543HCID 69655543, compound

Sources & evidence

ORD record
ord-70f3f61029b24652b63611c63e8bd380
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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