Reaction #208241

ord-20c23c2e531b4367ab9446349be93508

Reaction equation

O=C(n1ccnc1)n1ccnc1
O=C(n1ccnc1)n1ccnc1
CC(C)(O)C(=O)O
CC(C)(O)C(=O)O
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCNCC1
Cc1nc2ccccc2n1C1CC2C
ClCCCl
ClCCCl
[Na+]
[Na+]
O=C([O-])O
O=C([O-])O
→
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)C(C)(C)O)CC1
Cc1nc2ccccc2n1C1CC2C

Reactants

O=C(n1ccnc1)n1ccnc1
O=C(n1ccnc1)n1ccnc1
CC(C)(O)C(=O)O
CC(C)(O)C(=O)O
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCNCC1
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CC
ClCCCl
ClCCCl
[Na+]
[Na+]
O=C([O-])O
O=C([O-])O

Reagents

None

Source

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