9-butyl-N-(4-fluorophenyl)-6-(2-methoxyethoxy)purin-2-amine

Systemtic Name: 9-butyl-N-(4-fluorophenyl)-6-(2-methoxyethoxy)purin-2-amine Openeye Name: 9-butyl-N-(4-fluorophenyl)-6-(2-methoxyethoxy)purin-2-amine CAS Name: 9-butyl-N-(4-fluorophenyl)-6-(2-methoxyethoxy)-2-purinamine IUPAC Name: 9-butyl-N-(4-fluorophenyl)-6-(2-methoxyethoxy)purin-2-amine Traditional Name: [9-butyl-6-(2-methoxyethoxy)purin-2-yl]-(4-fluorophenyl)amine Formula: C18H22FN5O2 MolecularWeight: 359.397983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OCCOC)NC3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OCCOC)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN5O2/c1-3-4-9-24-12-20-15-16(24)22-18(23-17(15)26-11-10-25-2)21-14-7-5-13(19)6-8-14/h5-8,12H,3-4,9-11H2,1-2H3,(H,21,22,23)