Formic Acid → N-(cyanomethyl)-4-methyl-2-{phenyl[4-(piperazin-1-ylcarbonyl)phenyl]methoxy}pentanamide

HRID 1211549Notes

Reaction equation

HRID 1211549 reaction equation
[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[CH:7]([CH2:8][CH:9]([CH3:10])[CH3:11])[O:12][CH:13]([c:14]1[cH:15][cH:16][c:17]([C:18](=[O:19])[N:20]2[CH2:21][CH2:22][N:23]([C:26]([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:32])[CH2:24][CH2:25]2)[cH:33][cH:34]1)[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH:41]([OH:42])=[O:43]>>[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[CH:7]([CH2:8][CH:9]([CH3:10])[CH3:11])[O:12][CH:13]([c:14]1[cH:15][cH:16][c:17]([C:18](=[O:19])[N:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[cH:33][cH:34]1)[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1

Participants

3

Reactant 2

HCID 284Formic AcidHCID 86605379Tert-butyl 4-{4-[(1-{[(cyanomethyl)amino]carbonyl}-3-methylbutoxy)(phenyl)methyl]benzoyl}piperazine-1-carboxylate

Product 1

HCID 85089179N-(cyanomethyl)-4-methyl-2-{phenyl[4-(piperazin-1-ylcarbonyl)phenyl]methoxy}pentanamide

Sources & evidence

ORD record
ord-65087097985640b68626ca4cbac5e513
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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