2-[2-(2-ethanoylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(2-ethanoylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(2-acetylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(2-acetylphenoxy)ethylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(2-acetylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[2-(2-acetylphenoxy)ethylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C22H18N2O3S2/c1-14(25)16-9-5-6-10-18(16)27-11-12-28-22-23-20(26)19-17(13-29-21(19)24-22)15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,23,24,26)