SMIRKS
[C:1]([C:2](=[O:3])[S:4][C:5]1:[C:6]([H:12]):[C:7]([H:13]):[C:8]([H:14]):[C:9]([H:15]):[C:10]:1[H:16])([H:17])([H:18])[H:19]>>[H]O[C:2]([C:1]([H:17])([H:18])[H:19])=[O:3].[H][S:4][C:5]1:[C:6]([H:12]):[C:7]([H:13]):[C:8]([H:14]):[C:9]([H:15]):[C:10]:1[H:16]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E360 - Reaction Operator E
[#6:47]-[#16:48]-[#6:49](=[#8:50])-[#6@:51]>>[#6:49](=[#8:50])(-[#6@:51])-[#8]-[H].[#6:47]-[#16:48]-[H]
EVODEX.1-N1117 - Reaction Operator N
[#6:3]-[#6:4](=[#8:5])-[#16:6]-[#6:7]>>[H]-[#8]-[#6:4](-[#6:3])=[#8:5].[H]-[#16:6]-[#6:7]
EVODEX.1-Em589 - Reaction Operator Em
[#6:3]-[#6:4](=[#8:5])-[#16:6]-[#6:7]>>[H]-[#8]-[#6:4](-[#6:3])=[#8:5].[H]-[#16:6]-[#6:7]
EVODEX.1-Nm528 - Reaction Operator Nm
[#6:3]-[#6:4](=[#8:5])-[#16:6]-[#6:7]>>[H]-[#8]-[#6:4](-[#6:3])=[#8:5].[H]-[#16:6]-[#6:7]
Source Full Reactions
EVODEX.1-R4745
[C:1]([C:2](=[O:3])[S:4][C:5]1:[C:6]([H:12]):[C:7]([H:13]):[C:8]([H:14]):[C:9]([H:15]):[C:10]:1[H:16])([H:17])([H:18])[H:19].[H][O:11][H:20]>>[C:1]([C:2](=[O:3])[O:11][H:20])([H:17])([H:18])[H:19].[H][S:4][C:5]1:[C:6]([H:12]):[C:7]([H:13]):[C:8]([H:14]):[C:9]([H:15]):[C:10]:1[H:16]