Structure Information
Compound Identification
SMILES
CC(=O)O[C@@H]1[C@@H](COS(N)(=O)=O)O[C@H]([C@@H]1OC(C)=O)N1N=NC2=C1C=C(C=C2Br)C(F)(F)F
InChIKey
InChIKey=KICQENLKYGKIPA-NMFUWQPSSA-N
Formula
C16H16BrF3N4O8S
Mass
561.28
Compound Identification
SMILES
CC(=O)O[C@@H]1[C@@H](COS(N)(=O)=O)O[C@H]([C@@H]1OC(C)=O)N1N=NC2=C1C=C(C=C2Br)C(F)(F)F
InChIKey
InChIKey=KICQENLKYGKIPA-NMFUWQPSSA-N
Formula
C16H16BrF3N4O8S
Mass
561.28