1-methyl-5-[(4-methylsulfanylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-methyl-5-[(4-methylsulfanylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-methyl-5-[(4-methylsulfanylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-methyl-5-[[4-(methylthio)phenyl]methyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-methyl-5-[(4-methylsulfanylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-methyl-5-[4-(methylthio)benzyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=CC=C(C=C3)SC

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C14H14N4OS/c1-17-13-12(7-16-17)14(19)18(9-15-13)8-10-3-5-11(20-2)6-4-10/h3-7,9H,8H2,1-2H3