3-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-hydroxy-3-(4-propanoylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-hydroxy-3-(4-propanoylphenoxy)propyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-hydroxy-3-(4-propionylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O4S/c1-2-21(28)17-8-10-19(11-9-17)30-13-18(27)12-26-15-25-23-22(24(26)29)20(14-31-23)16-6-4-3-5-7-16/h3-11,14-15,18,27H,2,12-13H2,1H3