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

Systemtic Name: 1-(2-bromanyl-2-phenyl-ethyl)-6-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-bromo-2-phenyl-ethyl)-6-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-bromo-2-phenylethyl)-6-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(2-bromo-2-phenylethyl)-6-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-bromo-2-phenyl-ethyl)-6-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H13BrN4OS MolecularWeight: 365.24822

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C2=CNN(C2=N1)CC(C3=CC=CC=C3)Br

Isomeric SMILES

CSC1=NC(=O)C2=CNN(C2=N1)CC(C3=CC=CC=C3)Br

InChI

InChI=1S/C14H13BrN4OS/c1-21-14-17-12-10(13(20)18-14)7-16-19(12)8-11(15)9-5-3-2-4-6-9/h2-7,11,16H,8H2,1H3