Acetonitrile → 7-[3[(Ethylamino)methyl]-1-pyrrolidinyl]-6,8-difluoro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-3-quinolinecarboxylic acid

HRID 297830Notes

Reaction equation

HRID 297830 reaction equation
[CH2:23]([CH3:24])[NH:25][CH2:26][CH:27]1[CH2:28][NH:29][CH2:30][CH2:31]1.[CH3:32][C:33]#[N:34].[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:22])[c:6]([C:19](=[O:20])[OH:21])[cH:7][n:8](-[c:14]3[s:15][cH:16][cH:17][n:18]3)[c:9]2[c:10]([F:13])[c:11]1[F:12]>>[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:22])[c:6]([C:19](=[O:20])[OH:21])[cH:7][n:8](-[c:14]3[s:15][cH:16][cH:17][n:18]3)[c:9]2[c:10]([F:13])[c:11]1[N:29]1[CH2:28][CH:27]([CH2:26][NH:25][CH2:23][CH3:24])[CH2:31][CH2:30]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 118235706,7,8-Trifluoro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-3-quinolinecarboxylic acidHCID 13491786Ethyl-pyrrolidin-3-ylmethyl-amine

Product 1

HCID 137283327-[3[(Ethylamino)methyl]-1-pyrrolidinyl]-6,8-difluoro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-3-quinolinecarboxylic acid

Sources & evidence

ORD record
ord-60539809fa8149e8a87230587b67d45e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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