Acetonitrile → HCID 57986828, compound

HRID 1233992Notes

Reaction equation

HRID 1233992 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([c:14]2[s:15][cH:16][c:17]([CH2:19][Cl:20])[n:18]2)[CH2:11][CH2:12][CH2:13]1.[CH3:33][C:34]#[N:35].[n:21]1(-[c:26]2[cH:27][cH:28][c:29]([OH:32])[cH:30][cH:31]2)[n:22][n:23][n:24][cH:25]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([c:14]2[s:15][cH:16][c:17]([CH2:19][O:32][c:29]3[cH:28][cH:27][c:26](-[n:21]4[n:22][n:23][n:24][cH:25]4)[cH:31][cH:30]3)[n:18]2)[CH2:11][CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 5429104-(1H-1,2,3,4-tetrazol-1-yl)phenolHCID 57423801HCID 57423801, compound

Product 1

HCID 57986828HCID 57986828, compound

Sources & evidence

ORD record
ord-520c632288624897858ac2372de4f7f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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