2-[2,2-bis(butylsulfanyl)ethenyl]-1-methyl-pyridin-1-ium

Systemtic Name: 2-[2,2-bis(butylsulfanyl)ethenyl]-1-methyl-pyridin-1-ium Openeye Name: 2-[2,2-bis(butylsulfanyl)vinyl]-1-methyl-pyridin-1-ium CAS Name: 2-[2,2-bis(butylthio)ethenyl]-1-methylpyridin-1-ium IUPAC Name: 2-[2,2-bis(butylsulfanyl)ethenyl]-1-methylpyridin-1-ium Traditional Name: 2-[2,2-bis(butylthio)vinyl]-1-methyl-pyridin-1-ium Formula: C16H26NS2+ MolecularWeight: 296.51434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=CC1=CC=CC=[N+]1C)SCCCC

Isomeric SMILES

CCCCSC(=CC1=CC=CC=[N+]1C)SCCCC

InChI

InChI=1S/C16H26NS2/c1-4-6-12-18-16(19-13-7-5-2)14-15-10-8-9-11-17(15)3/h8-11,14H,4-7,12-13H2,1-3H3/q+1