6-methyl-3-methylsulfanyl-1-(2,4,6-trimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-methyl-3-methylsulfanyl-1-(2,4,6-trimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-methyl-3-methylsulfanyl-1-(2,4,6-trimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-methyl-3-(methylthio)-1-(2,4,6-trimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-methyl-3-methylsulfanyl-1-(2,4,6-trimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-mesityl-6-methyl-3-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H18N4OS MolecularWeight: 314.40532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C3=NC(=NC(=O)C3=C(N2)SC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C3=NC(=NC(=O)C3=C(N2)SC)C)C

InChI

InChI=1S/C16H18N4OS/c1-8-6-9(2)13(10(3)7-8)20-14-12(16(19-20)22-5)15(21)18-11(4)17-14/h6-7,19H,1-5H3