2-[(2-methylphenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-(o-tolylmethylsulfanyl)-1-oxido-pyridin-1-ium CAS Name: 2-[(2-methylphenyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 2-[(2-methylbenzyl)thio]-1-oxido-pyridin-1-ium Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=CC=CC=C1CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C13H13NOS/c1-11-6-2-3-7-12(11)10-16-13-8-4-5-9-14(13)15/h2-9H,10H2,1H3