Reaction #173993

ord-c5b9ffde44eb47fc9c4b4170e6f77bf0

Reaction equation

COC(C)(C)ON=C(C(=O)O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1
COC(C)(C)ON=C(C(=O)O
ClCCl
ClCCl
CCN(CC)CC
CCN(CC)CC
C(=NC1CCCCC1)=NC1CCCCC1
C(=NC1CCCCC1)=NC1CCC
NC(=O)N(C1CCCCC1)C1CCCCC1
NC(=O)N(C1CCCCC1)C1C
C[N+](=O)[O-]
C[N+](=O)[O-]
→
O=C(O)C(=NO)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1
O=C(O)C(=NO)c1csc(NC

Reactants

COC(C)(C)ON=C(C(=O)O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1
COC(C)(C)ON=C(C(=O)O)c1csc(NC(
ClCCl
ClCCl
CCN(CC)CC
CCN(CC)CC
C(=NC1CCCCC1)=NC1CCCCC1
C(=NC1CCCCC1)=NC1CCCCC1
NC(=O)N(C1CCCCC1)C1CCCCC1
NC(=O)N(C1CCCCC1)C1CCCCC1
C[N+](=O)[O-]
C[N+](=O)[O-]

Reagents

None

Source

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