Acetonitrile → HCID 3003383, compound

HRID 2155706Notes

Reaction equation

HRID 2155706 reaction equation
[CH3:33][C:34]#[N:35].[N:16](=[C:17]=[S:18])[c:19]1[cH:20][c:21]([C:29]([F:30])([F:31])[F:32])[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][n:13][s:14][cH:15]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][n:13][s:14][cH:15]2)[cH:6][cH:7]1)[C:17]([NH:16][c:19]1[cH:20][c:21]([C:29]([F:30])([F:31])[F:32])[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)=[S:18]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 27333953,5-Bis(trifluoromethyl)phenyl isothiocyanateHCID 12051700HCID 12051700, compound

Product 1

HCID 3003383HCID 3003383, compound

Sources & evidence

ORD record
ord-f84e6314ed894d64bd64d231f3defa7b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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