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

Systemtic Name: 1-(cyclohexylmethyl)-4,6-dimethyl-7-(3-methylbutyl)imidazo[1,2-a]purin-9-one Openeye Name: 1-(cyclohexylmethyl)-7-isopentyl-4,6-dimethyl-imidazo[1,2-a]purin-9-one CAS Name: 1-(cyclohexylmethyl)-4,6-dimethyl-7-(3-methylbutyl)-9-imidazo[1,2-a]purinone IUPAC Name: 1-(cyclohexylmethyl)-4,6-dimethyl-7-(3-methylbutyl)imidazo[1,2-a]purin-9-one Traditional Name: 1-(cyclohexylmethyl)-7-isoamyl-4,6-dimethyl-imidazo[1,2-a]purin-9-one Formula: C21H31N5O MolecularWeight: 369.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=O)C3=C(N=CN3CC4CCCCC4)N(C2=N1)C)CCC(C)C

Isomeric SMILES

CC1=C(N2C(=O)C3=C(N=CN3CC4CCCCC4)N(C2=N1)C)CCC(C)C

InChI

InChI=1S/C21H31N5O/c1-14(2)10-11-17-15(3)23-21-24(4)19-18(20(27)26(17)21)25(13-22-19)12-16-8-6-5-7-9-16/h13-14,16H,5-12H2,1-4H3