Isopropanol → N-[4-(4-amino-2-butyl-6,7-dimethyl-1H-imidazo[4,5-c]pyridin-1-yl)butyl]benzamide

HRID 120182

Reaction equation

HRID 120182 reaction equation
[C:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)(=[O:36])[Cl:37].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:38][CH2:39][S:40](=[O:41])(=[O:42])[OH:43].[CH:47]([OH:48])([CH3:49])[CH3:50].[Cl:44][CH2:45][Cl:46].[NH2:8][CH2:9][CH2:10][CH2:11][CH2:12][n:13]1[c:14]([CH2:25][CH2:26][CH2:27][CH3:28])[n:15][c:16]2[c:17]([NH2:24])[n:18][c:19]([CH3:23])[c:20]([CH3:22])[c:21]12>>[NH:8]([CH2:9][CH2:10][CH2:11][CH2:12][n:13]1[c:14]([CH2:25][CH2:26][CH2:27][CH3:28])[n:15][c:16]2[c:17]([NH2:24])[n:18][c:19]([CH3:23])[c:20]([CH3:22])[c:21]12)[C:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)=[O:36]

Participants

7

Reactant 6

HCID 3776IsopropanolHCID 6344DichloromethaneHCID 7412Benzoyl chlorideHCID 8471TriethylamineHCID 11668Ethanesulfonic acidHCID 120210831-(4-aminobutyl)-2-butyl-6,7-dimethyl-1H-imidazo[4,5-c]pyridin-4-amine

Product 1

HCID 10216053N-[4-(4-amino-2-butyl-6,7-dimethyl-1H-imidazo[4,5-c]pyridin-1-yl)butyl]benzamide

Sources & evidence

ORD record
ord-69711863ec3e4f60b0ec446b57725bde
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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