6-hexyl-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-hexyl-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-hexyl-4,7,8-trimethyl-2-(2-methylallyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-hexyl-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-hexyl-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-hexyl-4,7,8-trimethyl-2-(2-methylallyl)purin[7,8-a]imidazole-1,3-quinone Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(N2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=C)C)C)C

Isomeric SMILES

CCCCCCN1C(=C(N2C1=NC3=C2C(=O)N(C(=O)N3C)CC(=C)C)C)C

InChI

InChI=1S/C20H29N5O2/c1-7-8-9-10-11-23-14(4)15(5)25-16-17(21-19(23)25)22(6)20(27)24(18(16)26)12-13(2)3/h2,7-12H2,1,3-6H3