2-[(4-chlorophenyl)methylsulfanyl]-6-(furan-2-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(furan-2-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(2-furyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-[(4-chlorophenyl)methylthio]-6-(2-furanyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(furan-2-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-[(4-chlorobenzyl)thio]-6-(2-furyl)pyridin-1-ium-3-carbonitrile Formula: C17H12ClN2OS+ MolecularWeight: 327.80798

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=[NH+]C(=C(C=C2)C#N)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)C2=[NH+]C(=C(C=C2)C#N)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H11ClN2OS/c18-14-6-3-12(4-7-14)11-22-17-13(10-19)5-8-15(20-17)16-2-1-9-21-16/h1-9H,11H2/p+1