1,2-Dichloroethane → (4-Fluoro-3-methylsulfonyl-phenyl)-spiro[piperidine-4,4'-pyrrolo[2,1-c][1,4]benzoxazine]-1-yl-methanone

HRID 298631Notes

Reaction equation

HRID 298631 reaction equation
[CH2:40]([Cl:41])[CH2:42][Cl:43].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[Cl:44][CH2:45][Cl:46].[F:19][c:20]1[c:21]([S:29](=[O:30])(=[O:31])[CH3:32])[cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28]1.[cH:1]1[cH:2][cH:3][c:4]2[n:5]1-[c:6]1[c:7]([cH:15][cH:16][cH:17][cH:18]1)[O:8][C:9]21[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]1>>[cH:1]1[cH:2][cH:3][c:4]2[n:5]1-[c:6]1[c:7]([cH:15][cH:16][cH:17][cH:18]1)[O:8][C:9]21[CH2:10][CH2:11][N:12]([C:24]([c:23]2[cH:22][c:21]([S:29](=[O:30])(=[O:31])[CH3:32])[c:20]([F:19])[cH:28][cH:27]2)=[O:25])[CH2:13][CH2:14]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 6344DichloromethaneHCID 8471TriethylamineHCID 106803154-Fluoro-3-(methylsulphonyl)benzoic acidHCID 58550727Spiro[benzo[b]pyrrolo[1,2-d][1,4]oxazine-4,4'-piperidine]

Product 1

HCID 58551140(4-Fluoro-3-methylsulfonyl-phenyl)-spiro[piperidine-4,4'-pyrrolo[2,1-c][1,4]benzoxazine]-1-yl-methanone

Sources & evidence

ORD record
ord-1032c239ba9449bbb18db36dcf98e3ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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