6-azanyl-2-(butylamino)-9-(2-methylpropyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(butylamino)-9-(2-methylpropyl)-7H-purin-8-one Openeye Name: 6-amino-2-(butylamino)-9-isobutyl-7H-purin-8-one CAS Name: 6-amino-2-(butylamino)-9-(2-methylpropyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(butylamino)-9-(2-methylpropyl)-7H-purin-8-one Traditional Name: 6-amino-2-(butylamino)-9-isobutyl-7H-purin-8-one Formula: C13H22N6O MolecularWeight: 278.35338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N6O/c1-4-5-6-15-12-17-10(14)9-11(18-12)19(7-8(2)3)13(20)16-9/h8H,4-7H2,1-3H3,(H,16,20)(H3,14,15,17,18)