9-[(2-fluorophenyl)methyl]-N-pyrrol-1-yl-purin-6-amine

Systemtic Name: 9-[(2-fluorophenyl)methyl]-N-pyrrol-1-yl-purin-6-amine Openeye Name: 9-[(2-fluorophenyl)methyl]-N-pyrrol-1-yl-purin-6-amine CAS Name: 9-[(2-fluorophenyl)methyl]-N-(1-pyrrolyl)-6-purinamine IUPAC Name: 9-[(2-fluorophenyl)methyl]-N-pyrrol-1-ylpurin-6-amine Traditional Name: [9-(2-fluorobenzyl)purin-6-yl]-pyrrol-1-yl-amine Formula: C16H13FN6 MolecularWeight: 308.313023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C2N=CN=C3NN4C=CC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C2N=CN=C3NN4C=CC=C4)F

InChI

InChI=1S/C16H13FN6/c17-13-6-2-1-5-12(13)9-22-11-20-14-15(18-10-19-16(14)22)21-23-7-3-4-8-23/h1-8,10-11H,9H2,(H,18,19,21)