3-cyano-2-methyl-1-(2-methylphenyl)-5-pyridin-1-ium-1-yl-6-sulfanylidene-pyridin-4-olate

Systemtic Name: 3-cyano-2-methyl-1-(2-methylphenyl)-5-pyridin-1-ium-1-yl-6-sulfanylidene-pyridin-4-olate Openeye Name: 3-cyano-2-methyl-1-(o-tolyl)-5-pyridin-1-ium-1-yl-6-thioxo-pyridin-4-olate CAS Name: 3-cyano-2-methyl-1-(2-methylphenyl)-5-(1-pyridin-1-iumyl)-6-sulfanylidene-4-pyridinolate IUPAC Name: 3-cyano-2-methyl-1-(2-methylphenyl)-5-pyridin-1-ium-1-yl-6-sulfanylidenepyridin-4-olate Traditional Name: 3-cyano-2-methyl-1-(o-tolyl)-5-pyridin-1-ium-1-yl-6-thioxo-pyridin-4-olate Formula: C19H15N3OS MolecularWeight: 333.4069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=C(C2=S)[N+]3=CC=CC=C3)[O-])C#N)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=C(C2=S)[N+]3=CC=CC=C3)[O-])C#N)C

InChI

InChI=1S/C19H15N3OS/c1-13-8-4-5-9-16(13)22-14(2)15(12-20)18(23)17(19(22)24)21-10-6-3-7-11-21/h3-11H,1-2H3