4,7-dimethyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-6-prop-2-enyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-6-prop-2-enyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-allyl-4,7-dimethyl-2-[(1R)-1-methyl-2-oxo-propyl]purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-[(2R)-3-oxobutan-2-yl]-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-[(2R)-3-oxobutan-2-yl]-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-allyl-2-[(1R)-2-keto-1-methyl-propyl]-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CC=C)N(C(=O)N(C3=O)C(C)C(=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CC=C)N(C(=O)N(C3=O)[C@H](C)C(=O)C)C

InChI

InChI=1S/C16H19N5O3/c1-6-7-19-9(2)8-20-12-13(17-15(19)20)18(5)16(24)21(14(12)23)10(3)11(4)22/h6,8,10H,1,7H2,2-5H3/t10-/m1/s1