Chloroform → N-[4-(4-fluorophenyl)-2,2-dimethyl-3-thioxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl]methanesulfonamide

HRID 169977Notes

Reaction equation

HRID 169977 reaction equation
[CH3:26][O:27][c:28]1[cH:29][cH:30][c:31]([P:32]2(=[S:35])[S:33][P:34]([c:36]3[cH:37][cH:38][c:39]([O:40][CH3:41])[cH:42][cH:43]3)(=[S:44])[S:45]2)[cH:46][cH:47]1.[CH:54]([Cl:55])([Cl:56])[Cl:57].[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:25])[C:10]([CH3:23])([CH3:24])[O:11][c:12]3[c:13]2[cH:14][cH:15][c:16]([NH:18][S:19](=[O:20])(=[O:21])[CH3:22])[cH:17]3)[cH:6][cH:7]1.[O:48]1[CH2:49][CH2:50][O:51][CH2:52][CH2:53]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[S:35])[C:10]([CH3:23])([CH3:24])[O:11][c:12]3[c:13]2[cH:14][cH:15][c:16]([NH:18][S:19](=[O:20])(=[O:21])[CH3:22])[cH:17]3)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6212ChloroformHCID 312751,4-DioxaneHCID 87949Lawesson's reagentHCID 24744336Apararenone

Product 1

HCID 25217937N-[4-(4-fluorophenyl)-2,2-dimethyl-3-thioxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl]methanesulfonamide

Sources & evidence

ORD record
ord-aedb94de99a44987a7b24e483dd1ffec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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