Acetonitrile → HCID 178425705, compound

HRID 2322222Notes

Reaction equation

HRID 2322222 reaction equation
[Br:21][c:22]1[c:23]([N:28]=[C:29]=[O:30])[cH:24][cH:25][cH:26][cH:27]1.[CH3:1][c:2]1[cH:3][c:4]([O:5][CH2:6][CH:7]([CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[NH2:17])[cH:18][cH:19][cH:20]1.[CH3:31][C:32]#[N:33]>>[CH3:1][c:2]1[cH:3][c:4]([O:5][CH2:6][CH:7]([CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[NH:17][C:29]([NH:28][c:23]2[c:22]([Br:21])[cH:27][cH:26][cH:25][cH:24]2)=[O:30])[cH:18][cH:19][cH:20]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 1370972-Bromophenyl isocyanateHCID 178425719HCID 178425719, compound

Product 1

HCID 178425705HCID 178425705, compound

Sources & evidence

ORD record
ord-e88ff52442914086a61266bbaccd4e73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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