Acetonitrile → tert-butyl N-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]carbamate

Reaction equation

[C:17]([NH:18][NH2:19])(=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25].[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][CH2:11][S:12][CH3:13])[C:14](=[O:15])[OH:16].[CH3:26][C:27]#[N:28]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][CH2:11][S:12][CH3:13])[C:14](=[O:16])[NH:19][NH:18][C:17](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25]

Participants

Reactant 3

HCID 6342Acetonitrile

HCID 70091tert-Butyl carbazate

HCID 102827tert-butoxycarbonyl-L-methionine

Product 1

HCID 22727285tert-butyl N-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]carbamate

Sources & evidence

ORD record: ord-5aa823eadce242d18bc4e056126100f2
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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