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

Systemtic Name: 1-(3-chlorophenyl)-3-[(4-ethoxyphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-(3-chlorophenyl)-3-(4-ethoxyanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: 1-(3-chlorophenyl)-3-(4-ethoxyanilino)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-(3-chlorophenyl)-3-(4-ethoxyanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(3-chlorophenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-(p-phenetidino)-3-thioxo-prop-1-en-1-olate Formula: C23H21ClN2O2S MolecularWeight: 424.94304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)C(=C(C2=CC(=CC=C2)Cl)[O-])[N+]3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)C(=C(C2=CC(=CC=C2)Cl)[O-])[N+]3=CC=CC(=C3)C

InChI

InChI=1S/C23H21ClN2O2S/c1-3-28-20-11-9-19(10-12-20)25-23(29)21(26-13-5-6-16(2)15-26)22(27)17-7-4-8-18(24)14-17/h4-15H,3H2,1-2H3,(H-,25,27,29)