1-oxidanidyl-4-(phenylmethylsulfanyl)quinolin-1-ium

Systemtic Name: 1-oxidanidyl-4-(phenylmethylsulfanyl)quinolin-1-ium Openeye Name: 4-benzylsulfanyl-1-oxido-quinolin-1-ium CAS Name: 1-oxido-4-(phenylmethylthio)quinolin-1-ium IUPAC Name: 4-benzylsulfanyl-1-oxidoquinolin-1-ium Traditional Name: 4-(benzylthio)-1-oxido-quinolin-1-ium Formula: C16H13NOS MolecularWeight: 267.34552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=[N+](C3=CC=CC=C32)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=[N+](C3=CC=CC=C32)[O-]

InChI

InChI=1S/C16H13NOS/c18-17-11-10-16(14-8-4-5-9-15(14)17)19-12-13-6-2-1-3-7-13/h1-11H,12H2