9-[3,5-bis(fluoranyl)-4-methoxy-phenyl]-N-(dicyclopropylmethyl)-2,8-dimethyl-purin-6-amine

Systemtic Name: 9-[3,5-bis(fluoranyl)-4-methoxy-phenyl]-N-(dicyclopropylmethyl)-2,8-dimethyl-purin-6-amine Openeye Name: N-(dicyclopropylmethyl)-9-(3,5-difluoro-4-methoxy-phenyl)-2,8-dimethyl-purin-6-amine CAS Name: N-(dicyclopropylmethyl)-9-(3,5-difluoro-4-methoxyphenyl)-2,8-dimethyl-6-purinamine IUPAC Name: N-(dicyclopropylmethyl)-9-(3,5-difluoro-4-methoxyphenyl)-2,8-dimethylpurin-6-amine Traditional Name: dicyclopropylmethyl-[9-(3,5-difluoro-4-methoxy-phenyl)-2,8-dimethyl-purin-6-yl]amine Formula: C21H23F2N5O MolecularWeight: 399.437026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC(C3CC3)C4CC4)N=C(N2C5=CC(=C(C(=C5)F)OC)F)C

Isomeric SMILES

CC1=NC2=C(C(=N1)NC(C3CC3)C4CC4)N=C(N2C5=CC(=C(C(=C5)F)OC)F)C

InChI

InChI=1S/C21H23F2N5O/c1-10-24-20(27-17(12-4-5-12)13-6-7-13)18-21(25-10)28(11(2)26-18)14-8-15(22)19(29-3)16(23)9-14/h8-9,12-13,17H,4-7H2,1-3H3,(H,24,25,27)