1-[(E)-2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclopentan-1-ol

Systemtic Name: 1-[(E)-2-[6-azanyl-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclopentan-1-ol Openeye Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]vinyl]cyclopentanol CAS Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)-2-purinyl]ethenyl]-1-cyclopentanol IUPAC Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]ethenyl]cyclopentan-1-ol Traditional Name: 1-[(E)-2-[6-amino-9-cyclopropyl-8-(3-fluorophenyl)purin-2-yl]vinyl]cyclopentanol Formula: C21H22FN5O MolecularWeight: 379.430683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C=CC2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

Isomeric SMILES

C1CCC(C1)(/C=C/C2=NC3=C(C(=N2)N)N=C(N3C4CC4)C5=CC(=CC=C5)F)O

InChI

InChI=1S/C21H22FN5O/c22-14-5-3-4-13(12-14)19-26-17-18(23)24-16(8-11-21(28)9-1-2-10-21)25-20(17)27(19)15-6-7-15/h3-5,8,11-12,15,28H,1-2,6-7,9-10H2,(H2,23,24,25)/b11-8+