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

Systemtic Name: 1-(3,4-dimethylphenyl)-6-(2-methylpropylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3,4-dimethylphenyl)-6-isobutylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3,4-dimethylphenyl)-6-(2-methylpropylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(3,4-dimethylphenyl)-6-(2-methylpropylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3,4-dimethylphenyl)-6-(isobutylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(C)C)C

InChI

InChI=1S/C17H20N4OS/c1-10(2)9-23-17-19-15-14(16(22)20-17)8-18-21(15)13-6-5-11(3)12(4)7-13/h5-8,10,18H,9H2,1-4H3