Dimethyl Sulfoxide → HCID 18549165, compound

HRID 108167Notes

Reaction equation

HRID 108167 reaction equation
[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][S:45](=[O:46])[CH3:47].[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]3[n:8]([CH3:20])[cH:9][c:10]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[c:11](=[O:14])[c:12]3[cH:13]2)[cH:21][c:22]1[F:23].[F:24][c:25]1[cH:26][cH:27][c:28]([N:31]2[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[cH:29][cH:30]1>>[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]3[n:8]([CH3:20])[cH:9][c:10]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[c:11](=[O:14])[c:12]3[cH:13]2)[cH:21][c:22]1[N:34]1[CH2:33][CH2:32][N:31]([c:28]2[cH:27][cH:26][c:25]([F:24])[cH:30][cH:29]2)[CH2:36][CH2:35]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8471TriethylamineHCID 752601-(4-Fluorophenyl)piperazineHCID 98399873-Ethoxycarbonyl-7,8-difluoro-1-methyl-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine

Product 1

HCID 18549165HCID 18549165, compound

Sources & evidence

ORD record
ord-2d4e5597f57f4a769e5fd360046ccb83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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