1-methyl-4-methylsulfanyl-3-phenylsulfanyl-5-(3-propoxyphenyl)pyridin-1-ium

Systemtic Name: 1-methyl-4-methylsulfanyl-3-phenylsulfanyl-5-(3-propoxyphenyl)pyridin-1-ium Openeye Name: 1-methyl-4-methylsulfanyl-3-phenylsulfanyl-5-(3-propoxyphenyl)pyridin-1-ium CAS Name: 1-methyl-4-(methylthio)-3-(phenylthio)-5-(3-propoxyphenyl)pyridin-1-ium IUPAC Name: 1-methyl-4-methylsulfanyl-3-phenylsulfanyl-5-(3-propoxyphenyl)pyridin-1-ium Traditional Name: 1-methyl-4-(methylthio)-3-(phenylthio)-5-(3-propoxyphenyl)pyridin-1-ium Formula: C22H24NOS2+ MolecularWeight: 382.56206

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=C[N+](=CC(=C2SC)SC3=CC=CC=C3)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=C[N+](=CC(=C2SC)SC3=CC=CC=C3)C

InChI

InChI=1S/C22H24NOS2/c1-4-13-24-18-10-8-9-17(14-18)20-15-23(2)16-21(22(20)25-3)26-19-11-6-5-7-12-19/h5-12,14-16H,4,13H2,1-3H3/q+1