2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-5-bromanyl-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-5-bromanyl-1-oxidanidyl-pyridin-1-ium Openeye Name: 5-bromo-2-[(2,6-dichlorophenyl)methylsulfanyl]-1-oxido-pyridin-1-ium CAS Name: 5-bromo-2-[(2,6-dichlorophenyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 5-bromo-2-[(2,6-dichlorophenyl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 5-bromo-2-[(2,6-dichlorobenzyl)thio]-1-oxido-pyridin-1-ium Formula: C12H8BrCl2NOS MolecularWeight: 365.07302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=[N+](C=C(C=C2)Br)[O-])Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=[N+](C=C(C=C2)Br)[O-])Cl

InChI

InChI=1S/C12H8BrCl2NOS/c13-8-4-5-12(16(17)6-8)18-7-9-10(14)2-1-3-11(9)15/h1-6H,7H2