8-(3-fluorophenyl)-9-prop-2-enyl-purin-6-amine hydrochloride

Systemtic Name: 8-(3-fluorophenyl)-9-prop-2-enyl-purin-6-amine hydrochloride Openeye Name: 9-allyl-8-(3-fluorophenyl)purin-6-amine hydrochloride CAS Name: 8-(3-fluorophenyl)-9-prop-2-enyl-6-purinamine hydrochloride IUPAC Name: 8-(3-fluorophenyl)-9-prop-2-enylpurin-6-amine hydrochloride Traditional Name: [9-allyl-8-(3-fluorophenyl)purin-6-yl]amine hydrochloride Formula: C14H13ClFN5 MolecularWeight: 305.737923

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C(=NC=N2)N)N=C1C3=CC(=CC=C3)F.Cl

Isomeric SMILES

C=CCN1C2=C(C(=NC=N2)N)N=C1C3=CC(=CC=C3)F.Cl

InChI

InChI=1S/C14H12FN5.ClH/c1-2-6-20-13(9-4-3-5-10(15)7-9)19-11-12(16)17-8-18-14(11)20;/h2-5,7-8H,1,6H2,(H2,16,17,18);1H