2-[2-ethoxy-4-[(E)-(1-methyl-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]-6-prop-2-enyl-phenoxy]ethanoate

Systemtic Name: 2-[2-ethoxy-4-[(E)-(1-methyl-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]-6-prop-2-enyl-phenoxy]ethanoate Openeye Name: 2-[2-allyl-6-ethoxy-4-[(E)-(1-methyl-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]acetate CAS Name: 2-[2-ethoxy-4-[(E)-(1-methyl-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene)methyl]-6-prop-2-enylphenoxy]acetate IUPAC Name: 2-[2-ethoxy-4-[(E)-(1-methyl-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene)methyl]-6-prop-2-enylphenoxy]acetate Traditional Name: 2-[2-allyl-6-ethoxy-4-[(E)-(6-keto-1-methyl-4-oxido-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]acetate Formula: C19H18N2O6S-2 MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC(=O)[O-])CC=C)C=C2C(=NC(=S)N(C2=O)C)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC(=O)[O-])CC=C)/C=C/2\C(=NC(=S)N(C2=O)C)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-4-6-12-7-11(8-13-17(24)20-19(28)21(3)18(13)25)9-14(26-5-2)16(12)27-10-15(22)23/h4,7-9H,1,5-6,10H2,2-3H3,(H,22,23)(H,20,24,28)/p-2/b13-8+