(E)-3-[(2,6-dimethylphenyl)amino]-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: (E)-3-[(2,6-dimethylphenyl)amino]-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(2,6-dimethylanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(2,6-dimethylanilino)-1-(4-phenylphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(2,6-dimethylanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-3-(2,6-dimethylanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C28H24N2OS MolecularWeight: 436.56796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)C(=C(C2=CC=C(C=C2)C3=CC=CC=C3)[O-])[N+]4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)/C(=C(/C2=CC=C(C=C2)C3=CC=CC=C3)\[O-])/[N+]4=CC=CC=C4

InChI

InChI=1S/C28H24N2OS/c1-20-10-9-11-21(2)25(20)29-28(32)26(30-18-7-4-8-19-30)27(31)24-16-14-23(15-17-24)22-12-5-3-6-13-22/h3-19H,1-2H3,(H-,29,31,32)