1-[2-[6-azanyl-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]cyclohexan-1-ol

Systemtic Name: 1-[2-[6-azanyl-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]cyclohexan-1-ol Openeye Name: 1-[2-[6-amino-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]cyclohexanol CAS Name: 1-[2-[6-amino-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]-1-cyclohexanol IUPAC Name: 1-[2-[6-amino-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]cyclohexan-1-ol Traditional Name: 1-[2-[6-amino-8-(3-fluorophenyl)-7H-purin-2-yl]ethynyl]cyclohexanol Formula: C19H18FN5O MolecularWeight: 351.377523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=NC3=C(C(=N2)N)NC(=N3)C4=CC(=CC=C4)F)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=NC3=C(C(=N2)N)NC(=N3)C4=CC(=CC=C4)F)O

InChI

InChI=1S/C19H18FN5O/c20-13-6-4-5-12(11-13)17-24-15-16(21)22-14(23-18(15)25-17)7-10-19(26)8-2-1-3-9-19/h4-6,11,26H,1-3,8-9H2,(H3,21,22,23,24,25)