Reaction #229093

ord-8476e16ba15c45bcbe0d95097ce6cde7

Reaction equation

CC(C)(C)OC(=O)N1CCCC1C(=O)O

CC(C)(C)OC(=O)N1CCCC

Nc1ncnn2c(C3CCNCC3)cc(-c3ccc4cn(Cc5ccccc5)nc4c3)c12

Nc1ncnn2c(C3CCNCC3)c

CCN=C=NCCCN(C)C

CCN=C=NCCCN(C)C

CCN(C(C)C)C(C)C

CCN(C(C)C)C(C)C

CN(C)C=O

On1nnc2ccccc21

→

CC(C)(C)OC(=O)N1CCCC1C(=O)N1CCC(c2cc(-c3ccc4cn(Cc5ccccc5)nc4c3)c3c(N)ncnn23)CC1

CC(C)(C)OC(=O)N1CCCC

Reactants

CC(C)(C)OC(=O)N1CCCC1C(=O)O

Nc1ncnn2c(C3CCNCC3)cc(-c3ccc4c

CCN=C=NCCCN(C)C

CCN(C(C)C)C(C)C

Reagents

None

Source

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