2-(4-azanylpiperazin-1-yl)-N-(3-chlorophenyl)-9-ethyl-purin-6-amine

Systemtic Name: 2-(4-azanylpiperazin-1-yl)-N-(3-chlorophenyl)-9-ethyl-purin-6-amine Openeye Name: 2-(4-aminopiperazin-1-yl)-N-(3-chlorophenyl)-9-ethyl-purin-6-amine CAS Name: 2-(4-amino-1-piperazinyl)-N-(3-chlorophenyl)-9-ethyl-6-purinamine IUPAC Name: 2-(4-aminopiperazin-1-yl)-N-(3-chlorophenyl)-9-ethylpurin-6-amine Traditional Name: [2-(4-aminopiperazino)-9-ethyl-purin-6-yl]-(3-chlorophenyl)amine Formula: C17H21ClN8 MolecularWeight: 372.85524

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCN(CC4)N

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCN(CC4)N

InChI

InChI=1S/C17H21ClN8/c1-2-24-11-20-14-15(21-13-5-3-4-12(18)10-13)22-17(23-16(14)24)25-6-8-26(19)9-7-25/h3-5,10-11H,2,6-9,19H2,1H3,(H,21,22,23)