Acetonitrile → HCID 68528916, compound

HRID 1232354Notes

Reaction equation

HRID 1232354 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][c:12]2[c:13]3[c:14]([n:15][c:16]([NH2:18])[n:17]2)-[c:19]2[c:20]([n:24]([CH3:27])[n:25][cH:26]2)[CH2:21][CH2:22][CH2:23]3)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:28][N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[CH3:35][C:36]#[N:37]>>[c:12]1([N:32]2[CH2:31][CH2:30][N:29]([CH3:28])[CH2:34][CH2:33]2)[c:13]2[c:14]([n:15][c:16]([NH2:18])[n:17]1)-[c:19]1[c:20]([n:24]([CH3:27])[n:25][cH:26]1)[CH2:21][CH2:22][CH2:23]2

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 531671-MethylpiperazineHCID 86637696HCID 86637696, compound

Product 1

HCID 68528916HCID 68528916, compound

Sources & evidence

ORD record
ord-113ce8473ac342dbbf8a636b686c0d62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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