Acetone → Methyl 3-methyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

HRID 126104Notes

Reaction equation

HRID 126104 reaction equation
[Br:8][CH2:9][C:10]1([CH3:33])[S:11][CH:12]2[N:13]([CH:14]1[C:15](=[O:16])[O:17][CH3:18])[C:19](=[O:32])[CH:20]2[NH:21][C:22]([CH2:23][O:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)=[O:31].[CH3:1][c:2]1[n:3][n:4][c:5]([SH:7])[s:6]1.[CH3:39][C:40](=[O:41])[CH3:42].[O-:34][P:35](=[O:36])([O-:37])[O-:38]>>[CH3:1][c:2]1[n:3][n:4][c:5]([S:7][CH2:9][C:10]2([CH3:33])[S:11][CH:12]3[N:13]([CH:14]2[C:15](=[O:16])[O:17][CH3:18])[C:19](=[O:32])[CH:20]3[NH:21][C:22]([CH2:23][O:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)=[O:31])[s:6]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 1061PhosphateHCID 14110134HCID 14110134, compoundHCID 178434161HCID 178434161, compound

Product 1

HCID 23345955Methyl 3-methyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Sources & evidence

ORD record
ord-d62ddcad94094d7d81faddc93967c861
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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