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

Systemtic Name: (E)-3-[(2-fluorophenyl)amino]-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(2-fluoroanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(2-fluoroanilino)-1-(4-phenylphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(2-fluoroanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-3-(2-fluoroanilino)-1-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C26H19FN2OS MolecularWeight: 426.505263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=C(C(=S)NC3=CC=CC=C3F)[N+]4=CC=CC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C(=C(/C(=S)NC3=CC=CC=C3F)\[N+]4=CC=CC=C4)/[O-]

InChI

InChI=1S/C26H19FN2OS/c27-22-11-5-6-12-23(22)28-26(31)24(29-17-7-2-8-18-29)25(30)21-15-13-20(14-16-21)19-9-3-1-4-10-19/h1-18H,(H-,28,30,31)