2-chloranyl-9-cyclopentyl-N-[2-(3-imidazol-1-ylpropoxy)phenyl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[2-(3-imidazol-1-ylpropoxy)phenyl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[2-(3-imidazol-1-ylpropoxy)phenyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[2-[3-(1-imidazolyl)propoxy]phenyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[2-(3-imidazol-1-ylpropoxy)phenyl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[2-(3-imidazol-1-ylpropoxy)phenyl]amine Formula: C22H24ClN7O MolecularWeight: 437.92526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OCCCN5C=CN=C5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OCCCN5C=CN=C5)Cl

InChI

InChI=1S/C22H24ClN7O/c23-22-27-20(19-21(28-22)30(15-25-19)16-6-1-2-7-16)26-17-8-3-4-9-18(17)31-13-5-11-29-12-10-24-14-29/h3-4,8-10,12,14-16H,1-2,5-7,11,13H2,(H,26,27,28)