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9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)purin-2-amine

9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)purin-2-amine

Systemtic Name:9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)purin-2-amine
Openeye Name:9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)purin-2-amine
CAS Name:9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)-2-purinamine
IUPAC Name:9-butyl-N-(4-fluorophenyl)-6-(3-methoxyphenoxy)purin-2-amine
Traditional Name:[9-butyl-6-(3-methoxyphenoxy)purin-2-yl]-(4-fluorophenyl)amine
Formula: C22H22FN5O2
MolecularWeight: 407.440783
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OC3=CC(=CC=C3)OC)NC4=CC=C(C=C4)F


Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OC3=CC(=CC=C3)OC)NC4=CC=C(C=C4)F


InChI

InChI=1S/C22H22FN5O2/c1-3-4-12-28-14-24-19-20(28)26-22(25-16-10-8-15(23)9-11-16)27-21(19)30-18-7-5-6-17(13-18)29-2/h5-11,13-14H,3-4,12H2,1-2H3,(H,25,26,27)


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