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

Systemtic Name: 6-(2-chloroethyl)-2-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-chloroethyl)-2-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-chloroethyl)-2-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-chloroethyl)-2-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-chloroethyl)-2-ethyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C13H16ClN5O2 MolecularWeight: 309.75144

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C3N2C=C(N3CCCl)C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C3N2C=C(N3CCCl)C)N(C1=O)C

InChI

InChI=1S/C13H16ClN5O2/c1-4-17-11(20)9-10(16(3)13(17)21)15-12-18(6-5-14)8(2)7-19(9)12/h7H,4-6H2,1-3H3