2-[(diphenylmethyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(diphenylmethyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(benzhydrylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(diphenylmethyl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(benzhydrylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(benzhydrylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N2OS2/c1-14-15(2)27-22-19(14)21(25)23-18(24-22)13-26-20(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,20H,13H2,1-2H3,(H,23,24,25)