Reaction #191993

ord-4578f6d5637044c1af58cff664324094

Reaction equation

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCNCC1
Cc1nc2ccccc2n1C1CC2C
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2ccccc2S(=O)(=O)NC(=O)OC(C)(C)C)CC1
Cc1nc2ccccc2n1C1CC2C
O=C(O)c1ccc(S(=O)(=O)NC2CC2)c(Cl)c1
O=C(O)c1ccc(S(=O)(=O
O=C(O)c1cc(Cl)ccc1S(=O)(=O)NC1CC1
O=C(O)c1cc(Cl)ccc1S(
Cl
Cl
Cl
Cl
→
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2cc(Cl)ccc2S(=O)(=O)NC2CC2)CC1
Cc1nc2ccccc2n1C1CC2C

Reactants

Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCNCC1
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CC
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CCC1(c2ccccc2)CCN(C(=O)c2ccccc2S(=O)(=O)NC(=O)OC(C)(C)C)CC1
Cc1nc2ccccc2n1C1CC2CCC(C1)N2CC
O=C(O)c1ccc(S(=O)(=O)NC2CC2)c(Cl)c1
O=C(O)c1ccc(S(=O)(=O)NC2CC2)c(
O=C(O)c1cc(Cl)ccc1S(=O)(=O)NC1CC1
O=C(O)c1cc(Cl)ccc1S(=O)(=O)NC1
Cl
Cl
Cl
Cl

Reagents

None

Source

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