2-[4-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylbutylsulfanyl]-4,6-dimethyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-[4-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylbutylsulfanyl]-4,6-dimethyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-[4-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylbutylsulfanyl]-4,6-dimethyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-[4-[(3-cyano-4,6-dimethyl-2-pyridin-1-iumyl)thio]butylthio]-4,6-dimethyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[4-(3-cyano-4,6-dimethylpyridin-1-ium-2-yl)sulfanylbutylsulfanyl]-4,6-dimethylpyridin-1-ium-3-carbonitrile Traditional Name: 2-[4-[(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)thio]butylthio]-4,6-dimethyl-pyridin-1-ium-3-carbonitrile Formula: C20H24N4S2+2 MolecularWeight: 384.56136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C#N)SCCCCSC2=C(C(=CC(=[NH+]2)C)C)C#N)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C#N)SCCCCSC2=C(C(=CC(=[NH+]2)C)C)C#N)C

InChI

InChI=1S/C20H22N4S2/c1-13-9-15(3)23-19(17(13)11-21)25-7-5-6-8-26-20-18(12-22)14(2)10-16(4)24-20/h9-10H,5-8H2,1-4H3/p+2