Acetonitrile → HCID 10004789, compound

HRID 208161Notes

Reaction equation

HRID 208161 reaction equation
[Br:1][CH2:2][CH2:3][C:4](=[O:5])[NH:6][c:7]1[s:8][c:9](-[c:13]2[n:14][c:15]([NH:19][c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)[n:16][cH:17][cH:18]2)[c:10]([CH3:12])[n:11]1.[CH3:28][N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[CH3:35][C:36]#[N:37]>>[CH2:2]([CH2:3][C:4](=[O:5])[NH:6][c:7]1[s:8][c:9](-[c:13]2[n:14][c:15]([NH:19][c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)[n:16][cH:17][cH:18]2)[c:10]([CH3:12])[n:11]1)[N:32]1[CH2:31][CH2:30][N:29]([CH3:28])[CH2:34][CH2:33]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 531671-MethylpiperazineHCID 86600464HCID 86600464, compound

Product 1

HCID 10004789HCID 10004789, compound

Sources & evidence

ORD record
ord-e6494e9080634dfaa80d09660873bc11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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