9-[(4-chlorophenyl)methyl]-6-(furan-2-yl)purin-2-amine

Systemtic Name: 9-[(4-chlorophenyl)methyl]-6-(furan-2-yl)purin-2-amine Openeye Name: 9-[(4-chlorophenyl)methyl]-6-(2-furyl)purin-2-amine CAS Name: 9-[(4-chlorophenyl)methyl]-6-(2-furanyl)-2-purinamine IUPAC Name: 9-[(4-chlorophenyl)methyl]-6-(furan-2-yl)purin-2-amine Traditional Name: [9-(4-chlorobenzyl)-6-(2-furyl)purin-2-yl]amine Formula: C16H12ClN5O MolecularWeight: 325.75238

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C3C(=NC(=N2)N)N(C=N3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=COC(=C1)C2=C3C(=NC(=N2)N)N(C=N3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C16H12ClN5O/c17-11-5-3-10(4-6-11)8-22-9-19-14-13(12-2-1-7-23-12)20-16(18)21-15(14)22/h1-7,9H,8H2,(H2,18,20,21)