6-[(4-fluorophenyl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(4-fluorophenyl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(4-fluorophenyl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(4-fluorophenyl)methylamino]-3-(methylthio)-1,5-diphenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-[(4-fluorophenyl)methylamino]-3-methylsulfanyl-1,5-diphenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(4-fluorobenzyl)amino]-3-(methylthio)-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H20FN5OS MolecularWeight: 457.522603

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C2=C1C(=O)N(C(=N2)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=NN(C2=C1C(=O)N(C(=N2)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H20FN5OS/c1-33-23-21-22(31(29-23)20-10-6-3-7-11-20)28-25(27-16-17-12-14-18(26)15-13-17)30(24(21)32)19-8-4-2-5-9-19/h2-15H,16H2,1H3,(H,27,28)