3,6-dimethyl-1-(4-methylsulfonylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3,6-dimethyl-1-(4-methylsulfonylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3,6-dimethyl-1-(4-methylsulfonylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3,6-dimethyl-1-(4-methylsulfonylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3,6-dimethyl-1-(4-methylsulfonylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(4-mesylphenyl)-3,6-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H14N4O3S MolecularWeight: 318.35096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C)N(N1)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C)N(N1)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C14H14N4O3S/c1-8-12-13(15-9(2)16-14(12)19)18(17-8)10-4-6-11(7-5-10)22(3,20)21/h4-7,17H,1-3H3