3,6-diphenyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3,6-diphenyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3,6-diphenyl-2-(phenylmethylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-benzylsulfanyl-3,6-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C25H18N2OS2 MolecularWeight: 426.55322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C25H18N2OS2/c28-24-21-16-22(19-12-6-2-7-13-19)30-23(21)26-25(27(24)20-14-8-3-9-15-20)29-17-18-10-4-1-5-11-18/h1-16H,17H2