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

Systemtic Name: 2-[4-[(Z)-[1-(4-ethoxyphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]-2-methoxy-6-prop-2-enyl-phenoxy]ethanoate Openeye Name: 2-[2-allyl-4-[(Z)-[1-(4-ethoxyphenyl)-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene]methyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-[1-(4-ethoxyphenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]-2-methoxy-6-prop-2-enylphenoxy]acetate IUPAC Name: 2-[4-[(Z)-[1-(4-ethoxyphenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]-2-methoxy-6-prop-2-enylphenoxy]acetate Traditional Name: 2-[2-allyl-4-[(Z)-(6-keto-4-oxido-1-p-phenetyl-2-thioxo-pyrimidin-5-ylidene)methyl]-6-methoxy-phenoxy]acetate Formula: C25H22N2O7S-2 MolecularWeight: 494.51638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OCC(=O)[O-])CC=C)C(=NC2=S)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)OC)OCC(=O)[O-])CC=C)/C(=NC2=S)[O-]

InChI

InChI=1S/C25H24N2O7S/c1-4-6-16-11-15(13-20(32-3)22(16)34-14-21(28)29)12-19-23(30)26-25(35)27(24(19)31)17-7-9-18(10-8-17)33-5-2/h4,7-13H,1,5-6,14H2,2-3H3,(H,28,29)(H,26,30,35)/p-2/b19-12-