5,6-dimethyl-3-(4-methylphenyl)-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-(4-methylphenyl)-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5,6-dimethyl-3-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-(4-methylphenyl)-2-(phenylmethylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-benzylsulfanyl-5,6-dimethyl-3-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-5,6-dimethyl-3-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC(=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC(=C3C)C

InChI

InChI=1S/C22H20N2OS2/c1-14-9-11-18(12-10-14)24-21(25)19-15(2)16(3)27-20(19)23-22(24)26-13-17-7-5-4-6-8-17/h4-12H,13H2,1-3H3