Dichloromethane → 1,1-Dioxo-5-[2-phenylmethoxy-4-[2-(1,2,3,4-tetrahydroisoquinolin-3-yl)ethenyl]phenyl]-2-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-3-one

HRID 2345861Notes

Reaction equation

HRID 2345861 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[CH2:16][CH:17]1[CH:18]=[CH:19][c:20]1[cH:21][c:22]([O:40][CH2:41][c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:23]([N:26]2[S:27](=[O:38])(=[O:39])[N:28]([CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[C:29](=[O:31])[CH2:30]2)[cH:24][cH:25]1)([CH3:5])([CH3:6])[CH3:7].[Cl:55][CH2:56][Cl:57].[F:48][C:49]([F:50])([F:51])[C:52]([OH:53])=[O:54]>>[NH:8]1[CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[CH2:16][CH:17]1[CH:18]=[CH:19][c:20]1[cH:21][c:22]([O:40][CH2:41][c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:23]([N:26]2[S:27](=[O:38])(=[O:39])[N:28]([CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[C:29](=[O:31])[CH2:30]2)[cH:24][cH:25]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 68996829tert-butyl 3-[2-[3-phenylmethoxy-4-[1,1,4-trioxo-5-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-2-yl]phenyl]ethenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Product 1

HCID 689148631,1-Dioxo-5-[2-phenylmethoxy-4-[2-(1,2,3,4-tetrahydroisoquinolin-3-yl)ethenyl]phenyl]-2-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-3-one

Sources & evidence

ORD record
ord-622fbacee9314d5cb8ea79d09fd29135
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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