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

Systemtic Name: 6-azanyl-2-tert-butyl-9-(phenylmethyl)-7H-purin-8-one Openeye Name: 6-amino-9-benzyl-2-tert-butyl-7H-purin-8-one CAS Name: 6-amino-2-tert-butyl-9-(phenylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-9-benzyl-2-tert-butyl-7H-purin-8-one Traditional Name: 6-amino-9-benzyl-2-tert-butyl-7H-purin-8-one Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O/c1-16(2,3)14-19-12(17)11-13(20-14)21(15(22)18-11)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,18,22)(H2,17,19,20)