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Tetrahydrofuran → 7-Chloro-3-[4-(2-dimethylcarbamoyl-1,1-dimethyl-ethylcarbamoyl)-benzyl]-4-oxo-1-phenyl-1,4-dihydro-quinoline-2-carboxylic acid methyl ester

HRID 309003
Notes
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Reaction equation

HRID 309003 reaction equation
[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:7]2[cH:8][c:9]([Cl:26])[cH:10][cH:11][c:12]2[c:13](=[O:25])[c:14]1[CH2:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[OH:24])[cH:20][cH:21]1.[CH:43]([N:44]([CH2:45][CH3:46])[CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51].[NH2:33][C:34]([CH2:35][C:36](=[O:37])[N:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:7]2[cH:8][c:9]([Cl:26])[cH:10][cH:11][c:12]2[c:13](=[O:25])[c:14]1[CH2:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[NH:33][C:34]([CH2:35][C:36](=[O:37])[N:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42])[cH:20][cH:21]1
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 81531DiisopropylethylamineHCID 187922133-amino-N,N,3-trimethylbutanamideHCID 251817183-(4-Carboxybenzyl)-7-chloro-4-oxo-1-phenyl-1,4-dihydroquinoline-2-carboxylic acid methyl ester

Product 1

HCID 251818547-Chloro-3-[4-(2-dimethylcarbamoyl-1,1-dimethyl-ethylcarbamoyl)-benzyl]-4-oxo-1-phenyl-1,4-dihydro-quinoline-2-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-715cbff6cb2440b4ab7c30883c4bcec8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes