1-(4-methylphenyl)-6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(4-methylphenyl)-6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(2-phenylthiazol-4-yl)methylsulfanyl]-1-(p-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(4-methylphenyl)-6-[(2-phenyl-4-thiazolyl)methylthio]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(4-methylphenyl)-6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(2-phenylthiazol-4-yl)methylthio]-1-(p-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H17N5OS2 MolecularWeight: 431.53328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC4=CSC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC4=CSC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C22H17N5OS2/c1-14-7-9-17(10-8-14)27-19-18(11-23-27)20(28)26-22(25-19)30-13-16-12-29-21(24-16)15-5-3-2-4-6-15/h2-12,23H,13H2,1H3