1-methyl-7-(3-methylbutylsulfanyl)quinolin-1-ium

Systemtic Name: 1-methyl-7-(3-methylbutylsulfanyl)quinolin-1-ium Openeye Name: 7-isopentylsulfanyl-1-methyl-quinolin-1-ium CAS Name: 1-methyl-7-(3-methylbutylthio)quinolin-1-ium IUPAC Name: 1-methyl-7-(3-methylbutylsulfanyl)quinolin-1-ium Traditional Name: 7-(isoamylthio)-1-methyl-quinolin-1-ium Formula: C15H20NS+ MolecularWeight: 246.391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC2=C(C=CC=[N+]2C)C=C1

Isomeric SMILES

CC(C)CCSC1=CC2=C(C=CC=[N+]2C)C=C1

InChI

InChI=1S/C15H20NS/c1-12(2)8-10-17-14-7-6-13-5-4-9-16(3)15(13)11-14/h4-7,9,11-12H,8,10H2,1-3H3/q+1