SMIRKS
[H][N:11]([C@@:12]([C:13]([S:14][H:18])([H:19])[H:20])([C:15](=[O:16])[O:17][H:21])[H:22])[H:23].[H]N([H])[C:2](=[O:3])[C:4]([C:5]([C@@:6]([N:7]([H:25])[H:26])([C:8](=[O:9])[O:10][H:27])[H:28])([H:29])[H:30])([H:31])[H:32]>>[C:2](=[O:3])([C:4]([C:5]([C@@:6]([N:7]([H:25])[H:26])([C:8](=[O:9])[O:10][H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[N:11]([C@@:12]([C:13]([S:14][H:18])([H:19])[H:20])([C:15](=[O:16])[O:17][H:21])[H:22])[H:23]
Derived Operators
EVODEX.1-F73 - Elemental Balance
| N | -1 |
| H | -3 |
EVODEX.1-M12 - Mass Difference
-17.02659
EVODEX.1-E631 - Reaction Operator E
[#7:11](-[#6@@:12])(-[H:33])-[H].[#7](-[#6:2](=[#8:3])-[#6:4])(-[H])-[H]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11](-[#6@@:12])-[H:33]
EVODEX.1-N421 - Reaction Operator N
[H]-[#7:11](-[#6@@:12])-[H:32].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11](-[#6@@:12])-[H:32]
EVODEX.1-Em467 - Reaction Operator Em
[H]-[#7:11]-[#6:12].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11]-[#6:12]
EVODEX.1-Nm418 - Reaction Operator Nm
[H]-[#7:11]-[#6:12].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11]-[#6:12]
Source Full Reactions
EVODEX.1-R2887
[H][N:11]([C@@:12]([C:13]([S:14][H:18])([H:19])[H:20])([C:15](=[O:16])[O:17][H:21])[H:22])[H:23].[N:1]([C:2](=[O:3])[C:4]([C:5]([C@@:6]([N:7]([H:25])[H:26])([C:8](=[O:9])[O:10][H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34]>>[C:2](=[O:3])([C:4]([C:5]([C@@:6]([N:7]([H:25])[H:26])([C:8](=[O:9])[O:10][H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[N:11]([C@@:12]([C:13]([S:14][H:18])([H:19])[H:20])([C:15](=[O:16])[O:17][H:21])[H:22])[H:23].[H][N:1]([H:33])[H:34]