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

Systemtic Name: 3-[(2-ethoxyphenyl)amino]-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(2-ethoxyanilino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 3-(2-ethoxyanilino)-1-(4-ethylphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(2-ethoxyanilino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(4-ethylphenyl)-3-(o-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:

CCC1=CC=C(C=C1)C(=C(C(=S)NC2=CC=CC=C2OCC)[N+]3=CC=CC=C3)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=C(C(=S)NC2=CC=CC=C2OCC)[N+]3=CC=CC=C3)[O-]

InChI

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