(E)-3-[(2-ethoxyphenyl)amino]-1-(4-methoxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: (E)-3-[(2-ethoxyphenyl)amino]-1-(4-methoxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(2-ethoxyanilino)-1-(4-methoxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(2-ethoxyanilino)-1-(4-methoxyphenyl)-2-(3-methyl-1-imidazol-3-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(2-ethoxyanilino)-1-(4-methoxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-1-(4-methoxyphenyl)-2-(3-methylimidazol-3-ium-1-yl)-3-(o-phenetidino)-3-thioxo-prop-1-en-1-olate Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)C(=C(C2=CC=C(C=C2)OC)[O-])N3C=C[N+](=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)/C(=C(/C2=CC=C(C=C2)OC)\[O-])/N3C=C[N+](=C3)C

InChI

InChI=1S/C22H23N3O3S/c1-4-28-19-8-6-5-7-18(19)23-22(29)20(25-14-13-24(2)15-25)21(26)16-9-11-17(27-3)12-10-16/h5-15H,4H2,1-3H3,(H-,23,26,29)