Ethanol → N-(2,6-dimethylphenyl)-4-[(4-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl)amino]benzamide

Reaction equation

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

Participants

Reactant 2

HCID 702Ethanol

HCID 57662921N-(2,6-dimethylphenyl)-4-{[4-phenyl-7-(phenylmethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl]amino}benzamide

Product 1

HCID 57662967N-(2,6-dimethylphenyl)-4-[(4-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl)amino]benzamide

Sources & evidence

ORD record: ord-0fe76d37df60403db86df91bbb2440e1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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