5-(4-bromophenyl)-6-[(2-fluorophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 5-(4-bromophenyl)-6-[(2-fluorophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-6-[(2-fluorophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-6-[(2-fluorophenyl)methylthio]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-6-[(2-fluorophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)-6-[(2-fluorobenzyl)thio]pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C18H13BrFN5S MolecularWeight: 430.296723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=NN=CC3=C(N2C4=CC=C(C=C4)Br)N)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=NN=CC3=C(N2C4=CC=C(C=C4)Br)N)F

InChI

InChI=1S/C18H13BrFN5S/c19-12-5-7-13(8-6-12)25-16(21)14-9-22-24-17(14)23-18(25)26-10-11-3-1-2-4-15(11)20/h1-9H,10,21H2