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

Systemtic Name: 6-(2-chloroethyl)-2,4,7-trimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-chloroethyl)-2,4,7-trimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-chloroethyl)-2,4,7-trimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-chloroethyl)-2,4,7-trimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-chloroethyl)-2,4,7-trimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C12H14ClN5O2 MolecularWeight: 295.72486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCCl)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCCl)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C12H14ClN5O2/c1-7-6-18-8-9(14-11(18)17(7)5-4-13)15(2)12(20)16(3)10(8)19/h6H,4-5H2,1-3H3