5-(4-azanyl-1-cycloheptyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluoranyl-phenol

Systemtic Name: 5-(4-azanyl-1-cycloheptyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluoranyl-phenol Openeye Name: 5-(4-amino-1-cycloheptyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluoro-phenol CAS Name: 5-(4-amino-1-cycloheptyl-3-pyrazolo[3,4-d]pyrimidinyl)-2-fluorophenol IUPAC Name: 5-(4-amino-1-cycloheptylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenol Traditional Name: 5-(4-amino-1-cycloheptyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-fluoro-phenol Formula: C18H20FN5O MolecularWeight: 341.382703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2C3=C(C(=N2)C4=CC(=C(C=C4)F)O)C(=NC=N3)N

Isomeric SMILES

C1CCCC(CC1)N2C3=C(C(=N2)C4=CC(=C(C=C4)F)O)C(=NC=N3)N

InChI

InChI=1S/C18H20FN5O/c19-13-8-7-11(9-14(13)25)16-15-17(20)21-10-22-18(15)24(23-16)12-5-3-1-2-4-6-12/h7-10,12,25H,1-6H2,(H2,20,21,22)