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

Systemtic Name: 3-[(2-fluorophenyl)amino]-2-(4-propylpyridin-1-ium-1-yl)-3-sulfanylidene-1-thiophen-2-yl-prop-1-en-1-olate Openeye Name: 3-(2-fluoroanilino)-2-(4-propylpyridin-1-ium-1-yl)-1-(2-thienyl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-(2-fluoroanilino)-2-(4-propyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-thiophen-2-yl-1-propen-1-olate IUPAC Name: 3-(2-fluoroanilino)-2-(4-propylpyridin-1-ium-1-yl)-3-sulfanylidene-1-thiophen-2-ylprop-1-en-1-olate Traditional Name: 3-(2-fluoroanilino)-2-(4-propylpyridin-1-ium-1-yl)-1-(2-thienyl)-3-thioxo-prop-1-en-1-olate Formula: C21H19FN2OS2 MolecularWeight: 398.516763

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)C(=C(C2=CC=CS2)[O-])C(=S)NC3=CC=CC=C3F

Isomeric SMILES

CCCC1=CC=[N+](C=C1)C(=C(C2=CC=CS2)[O-])C(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C21H19FN2OS2/c1-2-6-15-10-12-24(13-11-15)19(20(25)18-9-5-14-27-18)21(26)23-17-8-4-3-7-16(17)22/h3-5,7-14H,2,6H2,1H3,(H-,23,25,26)