[(E)-1-methylsulfanylethylideneamino] 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-phenyl-benzoate

Systemtic Name: [(E)-1-methylsulfanylethylideneamino] 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-phenyl-benzoate Openeye Name: [(E)-1-methylsulfanylethylideneamino] 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-phenyl-benzoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-phenylbenzoic acid [(E)-1-(methylthio)ethylideneamino] ester IUPAC Name: [(E)-1-methylsulfanylethylideneamino] 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-phenylbenzoate Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-phenyl-benzoic acid [(E)-1-(methylthio)ethylideneamino] ester Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=C(C=CC=C1OC2=NC(=CC(=N2)OC)OC)C3=CC=CC=C3)SC

Isomeric SMILES

C/C(=N\OC(=O)C1=C(C=CC=C1OC2=NC(=CC(=N2)OC)OC)C3=CC=CC=C3)/SC

InChI

InChI=1S/C22H21N3O5S/c1-14(31-4)25-30-21(26)20-16(15-9-6-5-7-10-15)11-8-12-17(20)29-22-23-18(27-2)13-19(24-22)28-3/h5-13H,1-4H3/b25-14+