2-chloranyl-N-[2-(3-chloranylpropoxy)phenyl]-9-cyclopentyl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[2-(3-chloranylpropoxy)phenyl]-9-cyclopentyl-purin-6-amine Openeye Name: 2-chloro-N-[2-(3-chloropropoxy)phenyl]-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-N-[2-(3-chloropropoxy)phenyl]-9-cyclopentyl-6-purinamine IUPAC Name: 2-chloro-N-[2-(3-chloropropoxy)phenyl]-9-cyclopentylpurin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[2-(3-chloropropoxy)phenyl]amine Formula: C19H21Cl2N5O MolecularWeight: 406.30894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OCCCCl)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=CC=C4OCCCCl)Cl

InChI

InChI=1S/C19H21Cl2N5O/c20-10-5-11-27-15-9-4-3-8-14(15)23-17-16-18(25-19(21)24-17)26(12-22-16)13-6-1-2-7-13/h3-4,8-9,12-13H,1-2,5-7,10-11H2,(H,23,24,25)