(E)-2-cyano-1-(naphthalen-1-ylmethylsulfanyl)-2-pyridin-1-ium-1-yl-ethenethiolate

Systemtic Name: (E)-2-cyano-1-(naphthalen-1-ylmethylsulfanyl)-2-pyridin-1-ium-1-yl-ethenethiolate Openeye Name: (E)-2-cyano-1-(1-naphthylmethylsulfanyl)-2-pyridin-1-ium-1-yl-ethenethiolate CAS Name: (E)-2-cyano-1-(1-naphthalenylmethylthio)-2-(1-pyridin-1-iumyl)ethenethiolate IUPAC Name: (E)-2-cyano-1-(naphthalen-1-ylmethylsulfanyl)-2-pyridin-1-ium-1-ylethenethiolate Traditional Name: (E)-2-cyano-1-(1-naphthylmethylthio)-2-pyridin-1-ium-1-yl-ethenethiolate Formula: C19H14N2S2 MolecularWeight: 334.45786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=C([S-])SCC2=CC=CC3=CC=CC=C32)C#N

Isomeric SMILES

C1=CC=[N+](C=C1)/C(=C(\[S-])/SCC2=CC=CC3=CC=CC=C32)/C#N

InChI

InChI=1S/C19H14N2S2/c20-13-18(21-11-4-1-5-12-21)19(22)23-14-16-9-6-8-15-7-2-3-10-17(15)16/h1-12H,14H2/b19-18+