6-azanyl-2-(naphthalen-1-ylmethyl)-9-(phenylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(naphthalen-1-ylmethyl)-9-(phenylmethyl)-7H-purin-8-one Openeye Name: 6-amino-9-benzyl-2-(1-naphthylmethyl)-7H-purin-8-one CAS Name: 6-amino-2-(1-naphthalenylmethyl)-9-(phenylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-9-benzyl-2-(naphthalen-1-ylmethyl)-7H-purin-8-one Traditional Name: 6-amino-9-benzyl-2-(1-naphthylmethyl)-7H-purin-8-one Formula: C23H19N5O MolecularWeight: 381.42986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)CC4=CC=CC5=CC=CC=C54)N)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)CC4=CC=CC5=CC=CC=C54)N)NC2=O

InChI

InChI=1S/C23H19N5O/c24-21-20-22(28(23(29)27-20)14-15-7-2-1-3-8-15)26-19(25-21)13-17-11-6-10-16-9-4-5-12-18(16)17/h1-12H,13-14H2,(H,27,29)(H2,24,25,26)