4,6-dimethyl-7-(3-methylbutyl)-1H-imidazo[1,2-a]purin-9-one

Systemtic Name: 4,6-dimethyl-7-(3-methylbutyl)-1H-imidazo[1,2-a]purin-9-one Openeye Name: 7-isopentyl-4,6-dimethyl-1H-imidazo[1,2-a]purin-9-one CAS Name: 4,6-dimethyl-7-(3-methylbutyl)-1H-imidazo[1,2-a]purin-9-one IUPAC Name: 4,6-dimethyl-7-(3-methylbutyl)-1H-imidazo[1,2-a]purin-9-one Traditional Name: 7-isoamyl-4,6-dimethyl-1H-imidazo[1,2-a]purin-9-one Formula: C14H19N5O MolecularWeight: 273.33356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=O)C3=C(N=CN3)N(C2=N1)C)CCC(C)C

Isomeric SMILES

CC1=C(N2C(=O)C3=C(N=CN3)N(C2=N1)C)CCC(C)C

InChI

InChI=1S/C14H19N5O/c1-8(2)5-6-10-9(3)17-14-18(4)12-11(15-7-16-12)13(20)19(10)14/h7-8H,5-6H2,1-4H3,(H,15,16)