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

Systemtic Name: 2-azanyl-6-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-4-methyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-methylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-4-methylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-4-methyl-pyridin-1-ium-3,5-dicarbonitrile Formula: C16H12ClN4OS+ MolecularWeight: 343.81068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=CC=C(C=C2)Cl)N)C#N

Isomeric SMILES

CC1=C(C(=[NH+]C(=C1C#N)SCC(=O)C2=CC=C(C=C2)Cl)N)C#N

InChI

InChI=1S/C16H11ClN4OS/c1-9-12(6-18)15(20)21-16(13(9)7-19)23-8-14(22)10-2-4-11(17)5-3-10/h2-5H,8H2,1H3,(H2,20,21)/p+1