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

Systemtic Name: 3-[(2-ethoxyphenyl)amino]-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(2-ethoxyanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 3-(2-ethoxyanilino)-1-(4-fluorophenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(2-ethoxyanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(4-fluorophenyl)-3-(o-phenetidino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C22H19FN2O2S MolecularWeight: 394.461863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)C(=C(C2=CC=C(C=C2)F)[O-])[N+]3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)C(=C(C2=CC=C(C=C2)F)[O-])[N+]3=CC=CC=C3

InChI

InChI=1S/C22H19FN2O2S/c1-2-27-19-9-5-4-8-18(19)24-22(28)20(25-14-6-3-7-15-25)21(26)16-10-12-17(23)13-11-16/h3-15H,2H2,1H3,(H-,24,26,28)