5-(4-fluorophenyl)-6-methyl-2-[(2-methylphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-6-methyl-2-[(2-methylphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-6-methyl-2-(o-tolylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-6-methyl-2-[(2-methylphenyl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-6-methyl-2-[(2-methylphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-6-methyl-2-[(2-methylbenzyl)thio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17FN2OS2 MolecularWeight: 396.500883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=C(S3)C)C4=CC=C(C=C4)F)C(=O)N2

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=C(S3)C)C4=CC=C(C=C4)F)C(=O)N2

InChI

InChI=1S/C21H17FN2OS2/c1-12-5-3-4-6-15(12)11-26-21-23-19(25)18-17(13(2)27-20(18)24-21)14-7-9-16(22)10-8-14/h3-10H,11H2,1-2H3,(H,23,24,25)