methyl 3-[2-oxidanyl-3-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propoxy]benzoate

Systemtic Name: methyl 3-[2-oxidanyl-3-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propoxy]benzoate Openeye Name: methyl 3-[2-hydroxy-3-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propoxy]benzoate CAS Name: 3-[2-hydroxy-3-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-hydroxy-3-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propoxy]benzoate Traditional Name: 3-[2-hydroxy-3-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propoxy]benzoic acid methyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O

InChI

InChI=1S/C23H20N2O5S/c1-29-23(28)16-8-5-9-18(10-16)30-12-17(26)11-25-14-24-21-20(22(25)27)19(13-31-21)15-6-3-2-4-7-15/h2-10,13-14,17,26H,11-12H2,1H3