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

Systemtic Name: N-(3-chlorophenyl)-9-ethyl-2-piperidin-1-yl-purin-6-amine Openeye Name: N-(3-chlorophenyl)-9-ethyl-2-(1-piperidyl)purin-6-amine CAS Name: N-(3-chlorophenyl)-9-ethyl-2-(1-piperidinyl)-6-purinamine IUPAC Name: N-(3-chlorophenyl)-9-ethyl-2-piperidin-1-ylpurin-6-amine Traditional Name: (3-chlorophenyl)-(9-ethyl-2-piperidino-purin-6-yl)amine Formula: C18H21ClN6 MolecularWeight: 356.85254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCCCC4

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCCCC4

InChI

InChI=1S/C18H21ClN6/c1-2-24-12-20-15-16(21-14-8-6-7-13(19)11-14)22-18(23-17(15)24)25-9-4-3-5-10-25/h6-8,11-12H,2-5,9-10H2,1H3,(H,21,22,23)