2-[(2-methylphenyl)methylsulfanyl]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-(o-tolylmethylsulfanyl)-3-phenethyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(2-methylphenyl)methylthio]-3-phenethyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-3-phenethylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(2-methylbenzyl)thio]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C22H20N2OS2/c1-16-7-5-6-10-18(16)15-27-22-23-19-12-14-26-20(19)21(25)24(22)13-11-17-8-3-2-4-9-17/h2-10,12,14H,11,13,15H2,1H3