Tert-butyl 2-(6-amino-5-oxo-3-thiophen-2-yl-1,4-thiazepan-4-yl)acetate → Butyl 2-[[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-oxo-3-thiophen-2-yl-1,4-thiazepan-6-yl]amino]-4-phenylbutanoate

HRID 670333Notes

Reaction equation

HRID 670333 reaction equation
[Br:23][CH:24]([C:25](=[O:26])[O:27][CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[NH2:1][CH:2]1[C:3](=[O:22])[N:4]([CH2:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH:5]([c:9]2[s:10][cH:11][cH:12][cH:13]2)[CH2:6][S:7][CH2:8]1>>[NH:1]([CH:2]1[C:3](=[O:22])[N:4]([CH2:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH:5]([c:9]2[s:10][cH:11][cH:12][cH:13]2)[CH2:6][S:7][CH2:8]1)[CH:24]([C:25](=[O:26])[O:27][CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1

Participants

3

Reactant 2

HCID 13877950Tert-butyl 2-(6-amino-5-oxo-3-thiophen-2-yl-1,4-thiazepan-4-yl)acetateHCID 20164900HCID 20164900, compound

Product 1

HCID 20164843Butyl 2-[[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-oxo-3-thiophen-2-yl-1,4-thiazepan-6-yl]amino]-4-phenylbutanoate

Sources & evidence

ORD record
ord-f677ce8500eb4cc5859cc29bf750be9d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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