2-[4-(2-azanylethyl)piperidin-1-yl]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine

Systemtic Name: 2-[4-(2-azanylethyl)piperidin-1-yl]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine Openeye Name: 2-[4-(2-aminoethyl)-1-piperidyl]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine CAS Name: 2-[4-(2-aminoethyl)-1-piperidinyl]-N-(3-chlorophenyl)-9-ethyl-6-purinamine IUPAC Name: 2-[4-(2-aminoethyl)piperidin-1-yl]-N-(3-chlorophenyl)-9-ethylpurin-6-amine Traditional Name: [2-[4-(2-aminoethyl)piperidino]-9-ethyl-purin-6-yl]-(3-chlorophenyl)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)N4CCC(CC4)CCN

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCC(CC4)CCN

InChI

InChI=1S/C20H26ClN7/c1-2-27-13-23-17-18(24-16-5-3-4-15(21)12-16)25-20(26-19(17)27)28-10-7-14(6-9-22)8-11-28/h3-5,12-14H,2,6-11,22H2,1H3,(H,24,25,26)