Dichloromethane → 1-(3-Chloro-phenyl)-3-(3-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylamino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl}-benzyl)-urea

HRID 674948Notes

Reaction equation

HRID 674948 reaction equation
[Cl:33][c:34]1[cH:35][c:36]([N:40]=[C:41]=[O:42])[cH:37][cH:38][cH:39]1.[Cl:43][CH2:44][Cl:45].[NH2:1][CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][cH:12][c:13]3[n:14]2[n:15][c:16]([NH:18][c:19]2[cH:20][cH:21][c:22]([O:25][CH2:26][CH2:27][N:28]4[CH2:29][CH2:30][CH2:31][CH2:32]4)[cH:23][cH:24]2)[n:17]3)[cH:6][cH:7][cH:8]1>>[NH:1]([CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][cH:12][c:13]3[n:14]2[n:15][c:16]([NH:18][c:19]2[cH:20][cH:21][c:22]([O:25][CH2:26][CH2:27][N:28]4[CH2:29][CH2:30][CH2:31][CH2:32]4)[cH:23][cH:24]2)[n:17]3)[cH:6][cH:7][cH:8]1)[C:41]([NH:40][c:36]1[cH:35][c:34]([Cl:33])[cH:39][cH:38][cH:37]1)=[O:42]

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 17968Benzene, 1-chloro-3-isocyanato-HCID 59589633[5-(3-Aminomethyl-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-amine

Product 1

HCID 595901461-(3-Chloro-phenyl)-3-(3-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylamino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl}-benzyl)-urea

Sources & evidence

ORD record
ord-51e7ec3875534e77b364eb2bec7f34d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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