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

Systemtic Name: 2,4,7-trimethyl-6-[(2R)-3-oxidanylidenebutan-2-yl]purino[7,8-a]imidazole-1,3-dione Openeye Name: 2,4,7-trimethyl-6-[(1R)-1-methyl-2-oxo-propyl]purino[7,8-a]imidazole-1,3-dione CAS Name: 2,4,7-trimethyl-6-[(2R)-3-oxobutan-2-yl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2,4,7-trimethyl-6-[(2R)-3-oxobutan-2-yl]purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-[(1R)-2-keto-1-methyl-propyl]-2,4,7-trimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C(C)C(=O)C)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1[C@H](C)C(=O)C)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C14H17N5O3/c1-7-6-18-10-11(16(4)14(22)17(5)12(10)21)15-13(18)19(7)8(2)9(3)20/h6,8H,1-5H3/t8-/m1/s1