2-[(E)-but-2-enyl]-6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-[(E)-but-2-enyl]-6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-[(E)-but-2-enyl]-6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-[(E)-but-2-enyl]-6-butyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-[(E)-but-2-enyl]-6-butyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-[(E)-but-2-enyl]-6-butyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC=CC)C

Isomeric SMILES

CCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C/C=C/C)C

InChI

InChI=1S/C17H23N5O2/c1-5-7-9-20-12(3)11-22-13-14(18-16(20)22)19(4)17(24)21(15(13)23)10-8-6-2/h6,8,11H,5,7,9-10H2,1-4H3/b8-6+