9-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]purin-6-amine

Systemtic Name: 9-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]purin-6-amine Openeye Name: 9-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]purin-6-amine CAS Name: 9-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-6-purinamine IUPAC Name: 9-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]purin-6-amine Traditional Name: [9-[3-[4-(3-chlorophenyl)piperazino]propyl]purin-6-yl]amine Formula: C18H22ClN7 MolecularWeight: 371.86718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C=NC3=C2N=CN=C3N)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCCN2C=NC3=C2N=CN=C3N)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H22ClN7/c19-14-3-1-4-15(11-14)25-9-7-24(8-10-25)5-2-6-26-13-23-16-17(20)21-12-22-18(16)26/h1,3-4,11-13H,2,5-10H2,(H2,20,21,22)