SMIRKS
[N:1]#[C:2][C:3]([C:4]1:[C:5]([H:10]):[C:6]([H:11]):[C:7]([H:12]):[S:8]:1)([H:13])[H:14]>>[H][N:1]([H])[C:2](=O)[C:3]([C:4]1:[C:5]([H:10]):[C:6]([H:11]):[C:7]([H:12]):[S:8]:1)([H:13])[H:14]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E340 - Reaction Operator E
[#6:5](-[#6@:4])#[#7:6]>>[#6:5](-[#6@:4])(-[#7:6](-[H])-[H])=[#8]
Source Full Reactions
EVODEX.1-R7052
[N:1]#[C:2][C:3]([C:4]1:[C:5]([H:10]):[C:6]([H:11]):[C:7]([H:12]):[S:8]:1)([H:13])[H:14].[H][O:9][H]>>[H][N:1]([H])[C:2]([C:3]([C:4]1:[C:5]([H:10]):[C:6]([H:11]):[C:7]([H:12]):[S:8]:1)([H:13])[H:14])=[O:9]