6-azanyl-2-(3-methylbutylamino)-9-(oxan-4-ylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(3-methylbutylamino)-9-(oxan-4-ylmethyl)-7H-purin-8-one Openeye Name: 6-amino-2-(isopentylamino)-9-(tetrahydropyran-4-ylmethyl)-7H-purin-8-one CAS Name: 6-amino-2-(3-methylbutylamino)-9-(4-oxanylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(3-methylbutylamino)-9-(oxan-4-ylmethyl)-7H-purin-8-one Traditional Name: 6-amino-2-(isoamylamino)-9-(tetrahydropyran-4-ylmethyl)-7H-purin-8-one Formula: C16H26N6O2 MolecularWeight: 334.41664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC2=C(C(=N1)N)NC(=O)N2CC3CCOCC3

Isomeric SMILES

CC(C)CCNC1=NC2=C(C(=N1)N)NC(=O)N2CC3CCOCC3

InChI

InChI=1S/C16H26N6O2/c1-10(2)3-6-18-15-20-13(17)12-14(21-15)22(16(23)19-12)9-11-4-7-24-8-5-11/h10-11H,3-9H2,1-2H3,(H,19,23)(H3,17,18,20,21)