potassium 2-ethanethioyl-6-ethyl-4-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]phenolate

Systemtic Name: potassium 2-ethanethioyl-6-ethyl-4-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]phenolate Openeye Name: potassium 2-ethanethioyl-6-ethyl-4-[4-[(E)-2-(p-tolyl)vinyl]phenyl]phenolate CAS Name: potassium 2-ethyl-4-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]-6-(1-sulfanylideneethyl)phenolate IUPAC Name: potassium 2-ethanethioyl-6-ethyl-4-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]phenolate Traditional Name: potassium 2-ethyl-4-[4-[(E)-2-(p-tolyl)vinyl]phenyl]-6-thioacetyl-phenolate Formula: C25H23KOS MolecularWeight: 410.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1[O-])C(=S)C)C2=CC=C(C=C2)C=CC3=CC=C(C=C3)C.[K+]

Isomeric SMILES

CCC1=CC(=CC(=C1[O-])C(=S)C)C2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)C.[K+]

InChI

InChI=1S/C25H24OS.K/c1-4-21-15-23(16-24(18(3)27)25(21)26)22-13-11-20(12-14-22)10-9-19-7-5-17(2)6-8-19;/h5-16,26H,4H2,1-3H3;/q;+1/p-1/b10-9+;