Acetonitrile → HCID 13728331, compound

HRID 2318143Notes

Reaction equation

HRID 2318143 reaction equation
[CH2:25]([CH3:26])[NH:27][CH2:28][CH:29]1[CH2:30][NH:31][CH2:32][CH2:33]1.[CH3:34][C:35]#[N:36].[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:24])[c:6]([C:21](=[O:22])[OH:23])[cH:7][n:8](-[c:14]3[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]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:24])[c:6]([C:21](=[O:22])[OH:23])[cH:7][n:8](-[c:14]3[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]3)[c:9]2[c:10]([F:13])[c:11]1[N:31]1[CH2:30][CH:29]([CH2:28][NH:27][CH2:25][CH3:26])[CH2:33][CH2:32]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 13491786Ethyl-pyrrolidin-3-ylmethyl-amineHCID 137283301-(4-Fluorophenyl)-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

Product 1

HCID 13728331HCID 13728331, compound

Sources & evidence

ORD record
ord-a88082ce57e44220a4aca7c63344ac02
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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