6-(butylamino)-9-(phenylmethyl)-7H-purin-8-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC2=C1NC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CCCCNC1=NC=NC2=C1NC(=O)N2CC3=CC=CC=C3

InChI

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