6-azanyl-2-(butylamino)-9-(2-methyl-2-oxidanyl-propyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(butylamino)-9-(2-methyl-2-oxidanyl-propyl)-7H-purin-8-one Openeye Name: 6-amino-2-(butylamino)-9-(2-hydroxy-2-methyl-propyl)-7H-purin-8-one CAS Name: 6-amino-2-(butylamino)-9-(2-hydroxy-2-methylpropyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(butylamino)-9-(2-hydroxy-2-methylpropyl)-7H-purin-8-one Traditional Name: 6-amino-2-(butylamino)-9-(2-hydroxy-2-methyl-propyl)-7H-purin-8-one Formula: C13H22N6O2 MolecularWeight: 294.35278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)NC(=O)N2CC(C)(C)O

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)NC(=O)N2CC(C)(C)O

InChI

InChI=1S/C13H22N6O2/c1-4-5-6-15-11-17-9(14)8-10(18-11)19(12(20)16-8)7-13(2,3)21/h21H,4-7H2,1-3H3,(H,16,20)(H3,14,15,17,18)