6-[(2-chlorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(2-chlorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(2-chlorophenyl)methylsulfanyl]-5-(o-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(2-chlorophenyl)methylthio]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(2-chlorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(2-chlorobenzyl)thio]-5-(o-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H15ClN4OS MolecularWeight: 382.8666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(NN=C3)N=C2SCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(NN=C3)N=C2SCC4=CC=CC=C4Cl

InChI

InChI=1S/C19H15ClN4OS/c1-12-6-2-5-9-16(12)24-18(25)14-10-21-23-17(14)22-19(24)26-11-13-7-3-4-8-15(13)20/h2-10H,11H2,1H3,(H,21,23)