Acetonitrile → N-Cyano-N'-{2-[(4-methyl-5-imidazolyl)methylthio]ethyl}-N"-(4-pentyn-1-yl)guanidine

HRID 301087

Reaction equation

HRID 301087 reaction equation
[C:1](#[N:2])[NH:3][C:4]([S:5][CH3:6])=[N:7][CH2:8][CH2:9][S:10][CH2:11][c:12]1[c:13]([CH3:17])[n:14][cH:15][nH:16]1.[CH2:18]([CH2:19][CH2:20][C:21]#[CH:22])[NH2:23].[CH3:24][C:25]#[N:26].[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32]>>[C:1](#[N:2])[NH:3][C:4]([NH:7][CH2:8][CH2:9][S:10][CH2:11][c:12]1[c:13]([CH3:17])[n:14][cH:15][nH:16]1)=[N:23][CH2:18][CH2:19][CH2:20][C:21]#[CH:22]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 641001Pent-4-yn-1-amineHCID 178503877HCID 178503877, compound

Product 1

HCID 178446439N-Cyano-N'-{2-[(4-methyl-5-imidazolyl)methylthio]ethyl}-N"-(4-pentyn-1-yl)guanidine

Sources & evidence

ORD record
ord-02dcfb9b211a4c2e9ebf88df60ccbcd7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

Loading…