Reaction #224573

ord-ab18e4e4cdb6443893f3477c594d5aeb

Reaction equation

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2cccc(C#N)c2)CC1
Cc1nc2ccccc2n1C1CC2C
CCN(CC)CC
CCN(CC)CC
CO
CO
Cl
Cl
NO
NO
O
O
→
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2cccc(C(N)=NO)c2)CC1
Cc1nc2ccccc2n1C1CC2C

Reactants

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2cccc(C#N)c2)CC1
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CC
CCN(CC)CC
CCN(CC)CC
CO
CO
Cl
Cl
NO
NO
O
O

Reagents

None

Source

DOI: 10.1039/C8SC04228DTraining data from https://doi.org/10.1039/C8SC04228D (9/10)