Dimethyl Sulfoxide → HCID 14853346, compound

HRID 92005Notes

Reaction equation

HRID 92005 reaction equation
[CH3:26][N:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[CH3:33][S:34](=[O:35])[CH3:36].[CH:1]1([n:4]2[cH:5][c:6]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:7](=[O:20])[c:8]3[cH:9][c:10]4[c:11]([n:12][c:13]23)[cH:14][c:15]([F:19])[c:16]([F:18])[cH:17]4)[CH2:2][CH2:3]1.[CH:38]([O:39][CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[OH2:37]>>[CH:1]1([n:4]2[cH:5][c:6]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:7](=[O:20])[c:8]3[cH:9][c:10]4[c:11]([n:12][c:13]23)[cH:14][c:15]([N:30]2[CH2:29][CH2:28][N:27]([CH3:26])[CH2:32][CH2:31]2)[c:16]([F:18])[cH:17]4)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 7914Diisopropyl EtherHCID 531671-MethylpiperazineHCID 148533401-Cyclopropyl-3-ethoxycarbonyl-7,8-difluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine

Product 1

HCID 14853346HCID 14853346, compound

Sources & evidence

ORD record
ord-7163665f90fb40cbbaf5e27f12f9a7ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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