1-(1H-indol-3-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanone Openeye Name: 1-(1H-indol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-ethanone CAS Name: 1-(1H-indol-3-yl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]ethanone IUPAC Name: 1-(1H-indol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone Traditional Name: 1-(1H-indol-3-yl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]ethanone Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C15H12N2O2S/c18-14(10-20-15-7-3-4-8-17(15)19)12-9-16-13-6-2-1-5-11(12)13/h1-9,16H,10H2