N-methyl-2-pentyl-9-(phenylmethyl)purin-6-amine

Systemtic Name: N-methyl-2-pentyl-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-N-methyl-2-pentyl-purin-6-amine CAS Name: N-methyl-2-pentyl-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-N-methyl-2-pentylpurin-6-amine Traditional Name: (2-amyl-9-benzyl-purin-6-yl)-methyl-amine Formula: C18H23N5 MolecularWeight: 309.40872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(C(=N1)NC)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CCCCCC1=NC2=C(C(=N1)NC)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C18H23N5/c1-3-4-6-11-15-21-17(19-2)16-18(22-15)23(13-20-16)12-14-9-7-5-8-10-14/h5,7-10,13H,3-4,6,11-12H2,1-2H3,(H,19,21,22)