9-pentyl-8-(phenylmethyl)purine-2,6-diamine

Systemtic Name: 9-pentyl-8-(phenylmethyl)purine-2,6-diamine Openeye Name: 8-benzyl-9-pentyl-purine-2,6-diamine CAS Name: 9-pentyl-8-(phenylmethyl)purine-2,6-diamine IUPAC Name: 8-benzyl-9-pentylpurine-2,6-diamine Traditional Name: (2-amino-9-amyl-8-benzyl-purin-6-yl)amine Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1N=C(N=C2N)N)CC3=CC=CC=C3

Isomeric SMILES

CCCCCN1C(=NC2=C1N=C(N=C2N)N)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N6/c1-2-3-7-10-23-13(11-12-8-5-4-6-9-12)20-14-15(18)21-17(19)22-16(14)23/h4-6,8-9H,2-3,7,10-11H2,1H3,(H4,18,19,21,22)