alpha-Naphthyl isocyanate → 2-[1-(1-(N-(Naphth-1-yl)carbamoyl)piperidin-3-yl)ethylamino]-4-[5-(pyridin-4-yl)-benzimidazol-1-yl]pyrimidine

HRID 121261

Reaction equation

HRID 121261 reaction equation
[NH:1]1[CH2:2][CH:3]([CH:7]([CH3:8])[NH:9][c:10]2[n:11][cH:12][cH:13][c:14](-[n:16]3[cH:17][n:18][c:19]4[c:20]3[cH:21][cH:22][c:23](-[c:25]3[cH:26][cH:27][n:28][cH:29][cH:30]3)[cH:24]4)[n:15]2)[CH2:4][CH2:5][CH2:6]1.[c:31]1([N:41]=[C:42]=[O:43])[cH:32][cH:33][cH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12>>[N:1]1([C:42]([NH:41][c:31]2[cH:32][cH:33][cH:34][c:35]3[cH:36][cH:37][cH:38][cH:39][c:40]23)=[O:43])[CH2:2][CH:3]([CH:7]([CH3:8])[NH:9][c:10]2[n:11][cH:12][cH:13][c:14](-[n:16]3[cH:17][n:18][c:19]4[c:20]3[cH:21][cH:22][c:23](-[c:25]3[cH:26][cH:27][n:28][cH:29][cH:30]3)[cH:24]4)[n:15]2)[CH2:4][CH2:5][CH2:6]1

Participants

3

Reactant 2

HCID 66589alpha-Naphthyl isocyanateHCID 183326202-[1-(Piperidin-3-yl)-ethylamino]-4-[5-(pyridin-4-yl)-benzimidazol-1-yl]pyrimidine

Product 1

HCID 183326252-[1-(1-(N-(Naphth-1-yl)carbamoyl)piperidin-3-yl)ethylamino]-4-[5-(pyridin-4-yl)-benzimidazol-1-yl]pyrimidine

Sources & evidence

ORD record
ord-a0afd6cf75754a1f81e90e85581153df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…