N-(3-chlorophenyl)-2-piperazin-1-yl-9-propan-2-yl-purin-6-amine

Systemtic Name: N-(3-chlorophenyl)-2-piperazin-1-yl-9-propan-2-yl-purin-6-amine Openeye Name: N-(3-chlorophenyl)-9-isopropyl-2-piperazin-1-yl-purin-6-amine CAS Name: N-(3-chlorophenyl)-2-(1-piperazinyl)-9-propan-2-yl-6-purinamine IUPAC Name: N-(3-chlorophenyl)-2-piperazin-1-yl-9-propan-2-ylpurin-6-amine Traditional Name: (3-chlorophenyl)-(9-isopropyl-2-piperazino-purin-6-yl)amine Formula: C18H22ClN7 MolecularWeight: 371.86718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCNCC4

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCNCC4

InChI

InChI=1S/C18H22ClN7/c1-12(2)26-11-21-15-16(22-14-5-3-4-13(19)10-14)23-18(24-17(15)26)25-8-6-20-7-9-25/h3-5,10-12,20H,6-9H2,1-2H3,(H,22,23,24)