1-(3,4-dimethylphenyl)-3-[(4-ethoxyphenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(4-ethoxyphenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-(3,4-dimethylphenyl)-3-(4-ethoxyanilino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 1-(3,4-dimethylphenyl)-3-(4-ethoxyanilino)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-(3,4-dimethylphenyl)-3-(4-ethoxyanilino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(3,4-dimethylphenyl)-3-(p-phenetidino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O2S/c1-4-28-21-12-10-20(11-13-21)25-24(29)22(26-14-6-5-7-15-26)23(27)19-9-8-17(2)18(3)16-19/h5-16H,4H2,1-3H3,(H-,25,27,29)