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

Systemtic Name: 3-[(4-chlorophenyl)amino]-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(4-chloroanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 3-(4-chloroanilino)-1-(4-fluorophenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(4-chloroanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-(4-chloroanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C20H14ClFN2OS MolecularWeight: 384.854363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=C(C2=CC=C(C=C2)F)[O-])C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=[N+](C=C1)C(=C(C2=CC=C(C=C2)F)[O-])C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H14ClFN2OS/c21-15-6-10-17(11-7-15)23-20(26)18(24-12-2-1-3-13-24)19(25)14-4-8-16(22)9-5-14/h1-13H,(H-,23,25,26)