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

Systemtic Name: 3-[(3-chloranyl-4-methyl-phenyl)amino]-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(3-chloro-4-methyl-anilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 3-(3-chloro-4-methylanilino)-1-(4-fluorophenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(3-chloro-4-methylanilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-(3-chloro-4-methyl-anilino)-1-(4-fluorophenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C21H16ClFN2OS MolecularWeight: 398.880943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)C(=C(C2=CC=C(C=C2)F)[O-])[N+]3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)C(=C(C2=CC=C(C=C2)F)[O-])[N+]3=CC=CC=C3)Cl

InChI

InChI=1S/C21H16ClFN2OS/c1-14-5-10-17(13-18(14)22)24-21(27)19(25-11-3-2-4-12-25)20(26)15-6-8-16(23)9-7-15/h2-13H,1H3,(H-,24,26,27)