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

HRID 293714Notes

Reaction equation

HRID 293714 reaction equation
[Br:8][CH2:9][C:10]1([CH3:36])[S:11][CH:12]2[N:13]([CH:14]1[C:15](=[O:16])[O:17][CH2:18][C:19]([Cl:20])([Cl:21])[Cl:22])[C:23](=[O:35])[CH:24]2[NH:25][C:26]([CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)=[O:34].[CH3:1][c:2]1[n:3][n:4][c:5]([SH:7])[s:6]1.[CH3:42][C:43](=[O:44])[CH3:45].[O-:37][P:38](=[O:39])([O-:40])[O-:41]>>[CH3:1][c:2]1[n:3][n:4][c:5]([S:7][CH2:9][C:10]2([CH3:36])[S:11][CH:12]3[N:13]([CH:14]2[C:15](=[O:16])[O:17][CH2:18][C:19]([Cl:20])([Cl:21])[Cl:22])[C:23](=[O:35])[CH:24]3[NH:25][C:26]([CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)=[O:34])[s:6]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 1061PhosphateHCID 12895259HCID 12895259, compoundHCID 178434161HCID 178434161, compound

Product 1

HCID 233459742,2,2-Trichloroethyl 3-methyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Sources & evidence

ORD record
ord-db9bb7b8c9c347fc9e1d1696f13ae551
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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