Hydrochloric Acid → N-(4-Dipropylaminobutyl)-3-methyl-N-propyl-2-(8-trifluoromethyl-4-quinolylamino)benzamide

HRID 197556

Reaction equation

HRID 197556 reaction equation
[CH2:57]([CH2:58][CH3:59])[N:60]([CH2:61][CH2:62][CH2:63][CH2:64][NH:65][CH2:66][CH2:67][CH3:68])[CH2:69][CH2:70][CH3:71].[CH3:2][c:3]1[c:4]([NH:12][c:13]2[cH:14][cH:15][n:16][c:17]3[c:18]([C:23]([F:24])([F:25])[F:26])[cH:19][cH:20][cH:21][c:22]23)[c:5]([C:6](=[O:7])[Cl:8])[cH:9][cH:10][cH:11]1.[Cl:27][c:28]1[c:29]2[c:30]([c:31]([C:32]([F:33])([F:34])[F:35])[cH:36][cH:37][cH:38]2)[n:39][cH:40][cH:41]1.[ClH:1].[NH2:42][c:43]1[c:44]([CH3:45])[cH:46][cH:47][cH:48][c:49]1[C:50]([OH:51])=[O:52].[S:53]([Cl:54])([Cl:55])=[O:56]>>[CH3:2][c:3]1[c:4]([NH:12][c:13]2[cH:14][cH:15][n:16][c:17]3[c:18]([C:23]([F:24])([F:25])[F:26])[cH:19][cH:20][cH:21][c:22]23)[c:5]([C:6](=[O:7])[N:65]([CH2:64][CH2:63][CH2:62][CH2:61][N:60]([CH2:57][CH2:58][CH3:59])[CH2:69][CH2:70][CH3:71])[CH2:66][CH2:67][CH3:68])[cH:9][cH:10][cH:11]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 24386Thionyl ChlorideHCID 781012-Amino-3-methylbenzoic acidHCID 902624-Chloro-8-(trifluoromethyl)quinolineHCID 205201313-Methyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoyl chlorideHCID 205201501-Dipropylamino-4-propylaminobutane

Product 1

HCID 20520120N-(4-Dipropylaminobutyl)-3-methyl-N-propyl-2-(8-trifluoromethyl-4-quinolylamino)benzamide

Sources & evidence

ORD record
ord-29ec8e75178c49fbb1968008fbaa75e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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