2-azanyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-keto-2-(p-tolyl)ethyl]thio]-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C20H15N4OS2+ MolecularWeight: 391.4893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N

InChI

InChI=1S/C20H14N4OS2/c1-12-4-6-13(7-5-12)16(25)11-27-20-15(10-22)18(17-3-2-8-26-17)14(9-21)19(23)24-20/h2-8H,11H2,1H3,(H2,23,24)/p+1