6-azanyl-2-heptyl-9-(phenylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-heptyl-9-(phenylmethyl)-7H-purin-8-one Openeye Name: 6-amino-9-benzyl-2-heptyl-7H-purin-8-one CAS Name: 6-amino-2-heptyl-9-(phenylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-9-benzyl-2-heptyl-7H-purin-8-one Traditional Name: 6-amino-9-benzyl-2-heptyl-7H-purin-8-one Formula: C19H25N5O MolecularWeight: 339.4347

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C19H25N5O/c1-2-3-4-5-9-12-15-21-17(20)16-18(22-15)24(19(25)23-16)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,23,25)(H2,20,21,22)