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

Systemtic Name: 5-(2-chlorophenyl)-2-[(phenylmethylsulfanyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(benzylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-chlorophenyl)-2-[(phenylmethylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(benzylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(benzylthio)methyl]-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H15ClN2OS2 MolecularWeight: 398.9289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=NC3=C(C(=CS3)C4=CC=CC=C4Cl)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=NC3=C(C(=CS3)C4=CC=CC=C4Cl)C(=O)N2

InChI

InChI=1S/C20H15ClN2OS2/c21-16-9-5-4-8-14(16)15-11-26-20-18(15)19(24)22-17(23-20)12-25-10-13-6-2-1-3-7-13/h1-9,11H,10,12H2,(H,22,23,24)