2-[2-[(Z)-[1-(4-bromophenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[(Z)-[1-(4-bromophenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]phenoxy]ethanoate Openeye Name: 2-[2-[(Z)-[1-(4-bromophenyl)-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene]methyl]phenoxy]acetate CAS Name: 2-[2-[(Z)-[1-(4-bromophenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-[(Z)-[1-(4-bromophenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]phenoxy]acetate Traditional Name: 2-[2-[(Z)-[1-(4-bromophenyl)-6-keto-4-oxido-2-thioxo-pyrimidin-5-ylidene]methyl]phenoxy]acetate Formula: C19H11BrN2O5S-2 MolecularWeight: 459.27004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=NC(=S)N(C2=O)C3=CC=C(C=C3)Br)[O-])OCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C\2/C(=NC(=S)N(C2=O)C3=CC=C(C=C3)Br)[O-])OCC(=O)[O-]

InChI

InChI=1S/C19H13BrN2O5S/c20-12-5-7-13(8-6-12)22-18(26)14(17(25)21-19(22)28)9-11-3-1-2-4-15(11)27-10-16(23)24/h1-9H,10H2,(H,23,24)(H,21,25,28)/p-2/b14-9-