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

Systemtic Name: (E)-3-[(2-fluorophenyl)amino]-1-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(2-fluoroanilino)-1-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(2-fluoroanilino)-1-(4-methoxyphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(2-fluoroanilino)-1-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-3-(2-fluoroanilino)-1-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C21H17FN2O2S MolecularWeight: 380.435283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(C(=S)NC2=CC=CC=C2F)[N+]3=CC=CC=C3)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C(/C(=S)NC2=CC=CC=C2F)\[N+]3=CC=CC=C3)/[O-]

InChI

InChI=1S/C21H17FN2O2S/c1-26-16-11-9-15(10-12-16)20(25)19(24-13-5-2-6-14-24)21(27)23-18-8-4-3-7-17(18)22/h2-14H,1H3,(H-,23,25,27)