2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C18H18N2O2S/c21-17(14-23-18-8-4-5-11-20(18)22)19-12-9-16(10-13-19)15-6-2-1-3-7-15/h1-9,11H,10,12-14H2