4-tert-butyl-2-[(4-methoxyphenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 4-tert-butyl-2-[(4-methoxyphenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 4-tert-butyl-2-[(4-methoxyphenyl)methylsulfanyl]-1-oxido-pyridin-1-ium CAS Name: 4-tert-butyl-2-[(4-methoxyphenyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 4-tert-butyl-2-[(4-methoxyphenyl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 4-tert-butyl-1-oxido-2-(p-anisylthio)pyridin-1-ium Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=[N+](C=C1)[O-])SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C1=CC(=[N+](C=C1)[O-])SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H21NO2S/c1-17(2,3)14-9-10-18(19)16(11-14)21-12-13-5-7-15(20-4)8-6-13/h5-11H,12H2,1-4H3