Acetonitrile → HCID 67227906, compound

HRID 688703Notes

Reaction equation

HRID 688703 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:25][CH2:26][CH:27]([CH3:28])[CH3:29])[c:13]([N+:22]([O-:23])=[O:24])[c:14]3[n:15]([c:16]2[cH:17][cH:18]1)[n:19][n:20][n:21]3.[CH3:32][C:33]#[N:34].[H:30][H:31]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:25][CH2:26][CH:27]([CH3:28])[CH3:29])[c:13]([NH2:22])[c:14]3[n:15]([c:16]2[cH:17][cH:18]1)[n:19][n:20][n:21]3

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 67228436HCID 67228436, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 67227906HCID 67227906, compound

Sources & evidence

ORD record
ord-6d0e4ab5cf4147ac8fa1e9bd1f9567dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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