Dimethyl Sulfoxide → Gatifloxacin

HRID 695531Notes

Reaction equation

HRID 695531 reaction equation
[CH3:22][CH:23]1[NH:24][CH2:25][CH2:26][NH:27][CH2:28]1.[CH3:29][O:30][C:31](=[O:32])[O:33][CH3:34].[CH3:35][S:36]([CH3:37])=[O:38].[CH:1]1([n:4]2[cH:5][c:6]([C:19](=[O:20])[OH:21])[c:7](=[O:18])[c:8]3[cH:9][c:10]([F:17])[c:11]([F:16])[c:12]([O:14][CH3:15])[c:13]23)[CH2:2][CH2:3]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:19](=[O:20])[OH:21])[c:7](=[O:18])[c:8]3[cH:9][c:10]([F:17])[c:11]([N:27]4[CH2:26][CH2:25][NH:24][CH:23]([CH3:22])[CH2:28]4)[c:12]([O:14][CH3:15])[c:13]23)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 12021Dimethyl CarbonateHCID 660572-MethylpiperazineHCID 70194651-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acid

Product 1

HCID 5379Gatifloxacin

Sources & evidence

ORD record
ord-09b4937a74624528b4ed64e136f2f6c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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