Reaction #209841

ord-ef7768f3f7104f2b9722ad23a7801ce6

Reaction equation

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=NC#N)Oc2ccccc2)CC1
Cc1nc2ccccc2n1C1CC2C
C1CCOC1
C1CCOC1
CC(C)[S-]
CC(C)[S-]
[Na+]
[Na+]
→
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=NC#N)SC(C)C)CC1
Cc1nc2ccccc2n1C1CC2C

Reactants

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=NC#N)Oc2ccccc2)CC1
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CC
C1CCOC1
C1CCOC1
CC(C)[S-]
CC(C)[S-]
[Na+]
[Na+]

Reagents

None

Source

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