N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-9-cyclopentyl-purin-6-amine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-9-cyclopentyl-purin-6-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-9-cyclopentyl-purin-6-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-9-cyclopentyl-6-purinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-9-cyclopentylpurin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-homopiperonyl-amine Formula: C19H20ClN5O2 MolecularWeight: 385.8474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C19H20ClN5O2/c20-19-23-17(16-18(24-19)25(10-22-16)13-3-1-2-4-13)21-8-7-12-5-6-14-15(9-12)27-11-26-14/h5-6,9-10,13H,1-4,7-8,11H2,(H,21,23,24)