2-[2,2-bis(methylsulfanyl)ethenyl]-6-bromanyl-1-methyl-quinolin-1-ium

Systemtic Name: 2-[2,2-bis(methylsulfanyl)ethenyl]-6-bromanyl-1-methyl-quinolin-1-ium Openeye Name: 2-[2,2-bis(methylsulfanyl)vinyl]-6-bromo-1-methyl-quinolin-1-ium CAS Name: 2-[2,2-bis(methylthio)ethenyl]-6-bromo-1-methylquinolin-1-ium IUPAC Name: 2-[2,2-bis(methylsulfanyl)ethenyl]-6-bromo-1-methylquinolin-1-ium Traditional Name: 2-[2,2-bis(methylthio)vinyl]-6-bromo-1-methyl-quinolin-1-ium Formula: C14H15BrNS2+ MolecularWeight: 341.3096

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=C1C=CC(=C2)Br)C=C(SC)SC

Isomeric SMILES

C[N+]1=C(C=CC2=C1C=CC(=C2)Br)C=C(SC)SC

InChI

InChI=1S/C14H15BrNS2/c1-16-12(9-14(17-2)18-3)6-4-10-8-11(15)5-7-13(10)16/h4-9H,1-3H3/q+1