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

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-6-methyl-3-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(4-chloro-2-methyl-phenyl)-6-methyl-3-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(4-chloro-2-methylphenyl)-6-methyl-3-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(4-chloro-2-methylphenyl)-6-methyl-3-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(4-chloro-2-methyl-phenyl)-6-methyl-3-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN4OS/c1-7-6-9(15)4-5-10(7)19-12-11(14(18-19)21-3)13(20)17-8(2)16-12/h4-6,18H,1-3H3