N6-(3-chlorophenyl)-9-ethyl-N2-(2-piperidin-1-ylethyl)purine-2,6-diamine

Systemtic Name: N6-(3-chlorophenyl)-9-ethyl-N2-(2-piperidin-1-ylethyl)purine-2,6-diamine Openeye Name: N6-(3-chlorophenyl)-9-ethyl-N2-[2-(1-piperidyl)ethyl]purine-2,6-diamine CAS Name: N6-(3-chlorophenyl)-9-ethyl-N2-[2-(1-piperidinyl)ethyl]purine-2,6-diamine IUPAC Name: 6-N-(3-chlorophenyl)-9-ethyl-2-N-(2-piperidin-1-ylethyl)purine-2,6-diamine Traditional Name: [6-(3-chloroanilino)-9-ethyl-purin-2-yl]-(2-piperidinoethyl)amine Formula: C20H26ClN7 MolecularWeight: 399.92034

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN4CCCCC4

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN4CCCCC4

InChI

InChI=1S/C20H26ClN7/c1-2-28-14-23-17-18(24-16-8-6-7-15(21)13-16)25-20(26-19(17)28)22-9-12-27-10-4-3-5-11-27/h6-8,13-14H,2-5,9-12H2,1H3,(H2,22,24,25,26)