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

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-phenyl-2-(p-tolylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-methylphenyl)methylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-methylbenzyl)thio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H16N2OS2 MolecularWeight: 364.48384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C20H16N2OS2/c1-13-7-9-14(10-8-13)11-25-20-21-18(23)17-16(12-24-19(17)22-20)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,21,22,23)