1-[4-[bis(fluoranyl)methoxy]phenyl]-3-[(2-fluorophenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-[4-[bis(fluoranyl)methoxy]phenyl]-3-[(2-fluorophenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-[4-(difluoromethoxy)phenyl]-3-(2-fluoroanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: 1-[4-(difluoromethoxy)phenyl]-3-(2-fluoroanilino)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-[4-(difluoromethoxy)phenyl]-3-(2-fluoroanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-[4-(difluoromethoxy)phenyl]-3-(2-fluoroanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate Formula: C22H17F3N2O2S MolecularWeight: 430.44279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(C=C2)OC(F)F)[O-])C(=S)NC3=CC=CC=C3F

Isomeric SMILES

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(C=C2)OC(F)F)[O-])C(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C22H17F3N2O2S/c1-14-5-4-12-27(13-14)19(21(30)26-18-7-3-2-6-17(18)23)20(28)15-8-10-16(11-9-15)29-22(24)25/h2-13,22H,1H3,(H-,26,28,30)