2-heptyl-4,7-dimethyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-heptyl-4,7-dimethyl-6-propan-2-yl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-heptyl-6-isopropyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-heptyl-4,7-dimethyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-heptyl-4,7-dimethyl-6-propan-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-heptyl-6-isopropyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C19H29N5O2 MolecularWeight: 359.46586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)C2=C(N=C3N2C=C(N3C(C)C)C)N(C1=O)C

Isomeric SMILES

CCCCCCCN1C(=O)C2=C(N=C3N2C=C(N3C(C)C)C)N(C1=O)C

InChI

InChI=1S/C19H29N5O2/c1-6-7-8-9-10-11-22-17(25)15-16(21(5)19(22)26)20-18-23(15)12-14(4)24(18)13(2)3/h12-13H,6-11H2,1-5H3