N-(3-chloranyl-4-fluoranyl-phenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine hydrochloride

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine hydrochloride Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine hydrochloride CAS Name: N-(3-chloro-4-fluorophenyl)-1-methyl-4-pyrazolo[3,4-d]pyrimidinamine hydrochloride IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine hydrochloride Traditional Name: (3-chloro-4-fluoro-phenyl)-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amine hydrochloride Formula: C12H10Cl2FN5 MolecularWeight: 314.145703

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl.Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl.Cl

InChI

InChI=1S/C12H9ClFN5.ClH/c1-19-12-8(5-17-19)11(15-6-16-12)18-7-2-3-10(14)9(13)4-7;/h2-6H,1H3,(H,15,16,18);1H