2-[6-chloranyl-8-(3-fluorophenyl)purin-9-yl]propanenitrile

Systemtic Name: 2-[6-chloranyl-8-(3-fluorophenyl)purin-9-yl]propanenitrile Openeye Name: 2-[6-chloro-8-(3-fluorophenyl)purin-9-yl]propanenitrile CAS Name: 2-[6-chloro-8-(3-fluorophenyl)-9-purinyl]propanenitrile IUPAC Name: 2-[6-chloro-8-(3-fluorophenyl)purin-9-yl]propanenitrile Traditional Name: 2-[6-chloro-8-(3-fluorophenyl)purin-9-yl]propionitrile Formula: C14H9ClFN5 MolecularWeight: 301.706163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N1C2=C(C(=NC=N2)Cl)N=C1C3=CC(=CC=C3)F

Isomeric SMILES

CC(C#N)N1C2=C(C(=NC=N2)Cl)N=C1C3=CC(=CC=C3)F

InChI

InChI=1S/C14H9ClFN5/c1-8(6-17)21-13(9-3-2-4-10(16)5-9)20-11-12(15)18-7-19-14(11)21/h2-5,7-8H,1H3