Reaction #173406

ord-ff942aad11be433fac5e35465bbd4587

Reaction equation

CCN(CC)CC
CCN(CC)CC
CS(C)=O
CS(C)=O
[Cl-]
[Cl-]
Nc1c(F)c(F)c2c3c1c(=O)c(C(=O)O)cn3C1(CCOC1)CO2
Nc1c(F)c(F)c2c3c1c(=
[NH4+]
[NH4+]
O
O
NCCCc1ccccn1
NCCCc1ccccn1
→
Nc1c(F)c(NCCCc2ccccn2)c2c3c1c(=O)c(C(=O)O)cn3C1(CCOC1)CO2
Nc1c(F)c(NCCCc2ccccn

Reactants

CCN(CC)CC
CCN(CC)CC
CS(C)=O
CS(C)=O
[Cl-]
[Cl-]
Nc1c(F)c(F)c2c3c1c(=O)c(C(=O)O)cn3C1(CCOC1)CO2
Nc1c(F)c(F)c2c3c1c(=O)c(C(=O)O
[NH4+]
[NH4+]
O
O
NCCCc1ccccn1
NCCCc1ccccn1

Reagents

None

Source

DOI: 10.1039/C8SC04228DTraining data from https://doi.org/10.1039/C8SC04228D (2/10)