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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

InChI

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