2-azanyl-6-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]sulfanyl-4-methylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(3,4-dichlorophenyl)-2-oxoethyl]thio]-4-(methylthio)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl-4-methylsulfanylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-(3,4-dichlorophenyl)-2-keto-ethyl]thio]-4-(methylthio)pyridin-1-ium-3,5-dicarbonitrile Formula: C16H11Cl2N4OS2+ MolecularWeight: 410.32074

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=CC(=C(C=C2)Cl)Cl)N)C#N

Isomeric SMILES

CSC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=CC(=C(C=C2)Cl)Cl)N)C#N

InChI

InChI=1S/C16H10Cl2N4OS2/c1-24-14-9(5-19)15(21)22-16(10(14)6-20)25-7-13(23)8-2-3-11(17)12(18)4-8/h2-4H,7H2,1H3,(H2,21,22)/p+1