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

Systemtic Name: 5,6-dimethyl-3-phenyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-phenyl-2-(phenylmethylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-benzylsulfanyl-5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2OS2 MolecularWeight: 378.51042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H18N2OS2/c1-14-15(2)26-19-18(14)20(24)23(17-11-7-4-8-12-17)21(22-19)25-13-16-9-5-3-6-10-16/h3-12H,13H2,1-2H3