4-[[2-ethoxy-4-[(E)-(4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]-6-prop-2-enyl-phenoxy]methyl]benzoate

Systemtic Name: 4-[[2-ethoxy-4-[(E)-(4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]-6-prop-2-enyl-phenoxy]methyl]benzoate Openeye Name: 4-[[2-allyl-6-ethoxy-4-[(E)-(4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-ethoxy-4-[(E)-(4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene)methyl]-6-prop-2-enylphenoxy]methyl]benzoate IUPAC Name: 4-[[2-ethoxy-4-[(E)-(4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene)methyl]-6-prop-2-enylphenoxy]methyl]benzoate Traditional Name: 4-[[2-allyl-6-ethoxy-4-[(E)-(6-keto-4-oxido-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]methyl]benzoate Formula: C24H20N2O6S-2 MolecularWeight: 464.4904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)[O-])CC=C)C=C3C(=O)NC(=S)N=C3[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)[O-])CC=C)/C=C\3/C(=O)NC(=S)N=C3[O-]

InChI

InChI=1S/C24H22N2O6S/c1-3-5-17-10-15(11-18-21(27)25-24(33)26-22(18)28)12-19(31-4-2)20(17)32-13-14-6-8-16(9-7-14)23(29)30/h3,6-12H,1,4-5,13H2,2H3,(H,29,30)(H2,25,26,27,28,33)/p-2