5-(4-methoxyphenyl)-2-(phenylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methoxyphenyl)-2-(phenylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methoxyphenyl)-2-(phenylmethylthio)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H16N2O2S2 MolecularWeight: 380.48324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC4=CC=CC=C4

InChI

InChI=1S/C20H16N2O2S2/c1-24-15-9-7-14(8-10-15)16-12-25-19-17(16)18(23)21-20(22-19)26-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,22,23)