Reaction #261975

ord-c12ec0cf08334d1ab4dee04a24686a9f

Reaction equation

Clc1ncc(Br)c(Cl)n1
Clc1ncc(Br)c(Cl)n1
CC(C)(C)OC(=O)N1CCC(N)C1
CC(C)(C)OC(=O)N1CCC(
CCN(CC)CC
CCN(CC)CC
C1COCCO1
C1COCCO1
→
CC(C)(C)OC(=O)N1CCC(Nc2nc(Cl)ncc2Br)C1
CC(C)(C)OC(=O)N1CCC(

Reactants

Clc1ncc(Br)c(Cl)n1
Clc1ncc(Br)c(Cl)n1
CC(C)(C)OC(=O)N1CCC(N)C1
CC(C)(C)OC(=O)N1CCC(N)C1
CCN(CC)CC
CCN(CC)CC
C1COCCO1
C1COCCO1

Reagents

None

Source

DOI: 10.1039/C8SC04228DTraining data from https://doi.org/10.1039/C8SC04228D (6/10)