8-[(2-azanyl-2-methyl-propyl)amino]-3-methyl-1-(5-oxidanylhexyl)-7H-purine-2,6-dione

Systemtic Name: 8-[(2-azanyl-2-methyl-propyl)amino]-3-methyl-1-(5-oxidanylhexyl)-7H-purine-2,6-dione Openeye Name: 8-[(2-amino-2-methyl-propyl)amino]-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione CAS Name: 8-[(2-amino-2-methylpropyl)amino]-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione IUPAC Name: 8-[(2-amino-2-methylpropyl)amino]-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-dione Traditional Name: 8-[(2-amino-2-methyl-propyl)amino]-1-(5-hydroxyhexyl)-3-methyl-7H-purine-2,6-quinone Formula: C16H28N6O3 MolecularWeight: 352.43192

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2=C(N=C(N2)NCC(C)(C)N)N(C1=O)C)O

Isomeric SMILES

CC(CCCCN1C(=O)C2=C(N=C(N2)NCC(C)(C)N)N(C1=O)C)O

InChI

InChI=1S/C16H28N6O3/c1-10(23)7-5-6-8-22-13(24)11-12(21(4)15(22)25)20-14(19-11)18-9-16(2,3)17/h10,23H,5-9,17H2,1-4H3,(H2,18,19,20)