SMIRKS
[C:1]([S:2][C:3]([C:4]([N:5]([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])([H:40])[H:41]>>[H]C([H])([H])[S+:2]([C:1]([H:39])([H:40])[H:41])[C:3]([C:4]([N:5]([H:33])[H:34])([H:35])[H:36])([H:37])[H:38]
Derived Operators
EVODEX.1-M269 - Mass Difference
15.02349
EVODEX.1-E881 - Reaction Operator E
[#6:1]-[#16:2]-[#6:3]>>[#6:1]-[#16:2](-[#6:3])-[#6](-[H])(-[H])-[H]
EVODEX.1-N281 - Reaction Operator N
[#6:1]-[#16:2]-[#6:3]>>[H]-[#6](-[H])(-[H])-[#16:2](-[#6:1])-[#6:3]
EVODEX.1-Em406 - Reaction Operator Em
[#6:1]-[#16:2]-[#6:3]>>[H]-[#6](-[H])(-[H])-[#16:2](-[#6:1])-[#6:3]
EVODEX.1-Nm366 - Reaction Operator Nm
[#6:1]-[#16:2]-[#6:3]>>[H]-[#6](-[H])(-[H])-[#16:2](-[#6:1])-[#6:3]
Source Full Reactions
EVODEX.1-R1828
[C:1]([S:2][C:3]([C:4]([N:5]([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])([H:40])[H:41].[C:6]([S+:7]([C:8]([C:9]([C@:10]([N:11]([H:42])[H:43])([C:12](=[O:13])[O:14][H:44])[H:45])([H:46])[H:47])([H:48])[H:49])[C:15]([C@@:16]1([H:50])[O:17][C@:18]([N:19]2:[C:20]([H:51]):[N:21]:[C:22]3:[C:23]([N:24]([H:52])[H:53]):[N:25]:[C:26]([H:54]):[N:27]:[C:28]:2:3)([H:55])[C@@:29]([O:30][H:56])([H:57])[C@@:31]1([O:32][H:58])[H:59])([H:60])[H:61])([H:62])([H:63])[H:64]>>[C:1]([S+:2]([C:3]([C:4]([N:5]([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])[C:6]([H:62])([H:63])[H:64])([H:39])([H:40])[H:41].[S:7]([C:8]([C:9]([C@:10]([N:11]([H:42])[H:43])([C:12](=[O:13])[O:14][H:44])[H:45])([H:46])[H:47])([H:48])[H:49])[C:15]([C@@:16]1([H:50])[O:17][C@:18]([N:19]2:[C:20]([H:51]):[N:21]:[C:22]3:[C:23]([N:24]([H:52])[H:53]):[N:25]:[C:26]([H:54]):[N:27]:[C:28]:2:3)([H:55])[C@@:29]([O:30][H:56])([H:57])[C@@:31]1([O:32][H:58])[H:59])([H:60])[H:61]