9-(3-methylbutyl)-N-(phenylmethyl)purin-6-amine

Systemtic Name: 9-(3-methylbutyl)-N-(phenylmethyl)purin-6-amine Openeye Name: N-benzyl-9-isopentyl-purin-6-amine CAS Name: 9-(3-methylbutyl)-N-(phenylmethyl)-6-purinamine IUPAC Name: N-benzyl-9-(3-methylbutyl)purin-6-amine Traditional Name: benzyl-(9-isoamylpurin-6-yl)amine Formula: C17H21N5 MolecularWeight: 295.38214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=NC2=C1N=CN=C2NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C=NC2=C1N=CN=C2NCC3=CC=CC=C3

InChI

InChI=1S/C17H21N5/c1-13(2)8-9-22-12-21-15-16(19-11-20-17(15)22)18-10-14-6-4-3-5-7-14/h3-7,11-13H,8-10H2,1-2H3,(H,18,19,20)