2-[6-azanyl-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-1-ethenyl-cyclobutan-1-ol

Systemtic Name: 2-[6-azanyl-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-1-ethenyl-cyclobutan-1-ol Openeye Name: 2-[6-amino-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-1-vinyl-cyclobutanol CAS Name: 2-[6-amino-8-(3-fluorophenyl)-9-propyl-2-purinyl]-1-ethenyl-1-cyclobutanol IUPAC Name: 2-[6-amino-8-(3-fluorophenyl)-9-propylpurin-2-yl]-1-ethenylcyclobutan-1-ol Traditional Name: 2-[6-amino-8-(3-fluorophenyl)-9-propyl-purin-2-yl]-1-vinyl-cyclobutanol Formula: C20H22FN5O MolecularWeight: 367.419983

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C3CCC3(C=C)O)N)N=C1C4=CC(=CC=C4)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C3CCC3(C=C)O)N)N=C1C4=CC(=CC=C4)F

InChI

InChI=1S/C20H22FN5O/c1-3-10-26-18(12-6-5-7-13(21)11-12)23-15-16(22)24-17(25-19(15)26)14-8-9-20(14,27)4-2/h4-7,11,14,27H,2-3,8-10H2,1H3,(H2,22,24,25)