N-[3,4-bis(fluoranyl)phenyl]-2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-amine

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-amine Openeye Name: N-(3,4-difluorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-amine CAS Name: N-(3,4-difluorophenyl)-2-(3,5-dimethyl-1-pyrazolyl)-9-methyl-6-purinamine IUPAC Name: N-(3,4-difluorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-methylpurin-6-amine Traditional Name: (3,4-difluorophenyl)-[2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-yl]amine Formula: C17H15F2N7 MolecularWeight: 355.344706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=C(C(=N2)NC4=CC(=C(C=C4)F)F)N=CN3C)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=C(C(=N2)NC4=CC(=C(C=C4)F)F)N=CN3C)C

InChI

InChI=1S/C17H15F2N7/c1-9-6-10(2)26(24-9)17-22-15(14-16(23-17)25(3)8-20-14)21-11-4-5-12(18)13(19)7-11/h4-8H,1-3H3,(H,21,22,23)