4,7-dimethyl-2-prop-2-enyl-6H-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-prop-2-enyl-6H-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-allyl-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-prop-2-enyl-6H-purino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-prop-2-enyl-6H-purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-allyl-4,7-dimethyl-6H-purin[7,8-a]imidazole-1,3-quinone Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CC=C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CC=C)C

InChI

InChI=1S/C12H13N5O2/c1-4-5-16-10(18)8-9(15(3)12(16)19)14-11-13-7(2)6-17(8)11/h4,6H,1,5H2,2-3H3,(H,13,14)