2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(2,3,5,6-tetramethylphenyl)ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(2,3,5,6-tetramethylphenyl)ethanone Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(2,3,5,6-tetramethylphenyl)ethanone CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-(2,3,5,6-tetramethylphenyl)ethanone IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(2,3,5,6-tetramethylphenyl)ethanone Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-1-(2,3,5,6-tetramethylphenyl)ethanone Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)CSC2=CC=CC=[N+]2[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)CSC2=CC=CC=[N+]2[O-])C)C

InChI

InChI=1S/C17H19NO2S/c1-11-9-12(2)14(4)17(13(11)3)15(19)10-21-16-7-5-6-8-18(16)20/h5-9H,10H2,1-4H3