6-(5-chloranyl-2-methoxy-phenyl)-2-ethyl-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(5-chloranyl-2-methoxy-phenyl)-2-ethyl-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(5-chloro-2-methoxy-phenyl)-2-ethyl-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(5-chloro-2-methoxyphenyl)-2-ethyl-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(5-chloro-2-methoxyphenyl)-2-ethyl-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(5-chloro-2-methoxy-phenyl)-2-ethyl-4-methyl-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C17H18ClN5O3 MolecularWeight: 375.80952

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C3N2CCN3C4=C(C=CC(=C4)Cl)OC)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C3N2CCN3C4=C(C=CC(=C4)Cl)OC)N(C1=O)C

InChI

InChI=1S/C17H18ClN5O3/c1-4-21-15(24)13-14(20(2)17(21)25)19-16-22(7-8-23(13)16)11-9-10(18)5-6-12(11)26-3/h5-6,9H,4,7-8H2,1-3H3