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

Systemtic Name: 2-[(3-chlorophenyl)methyl]-6-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-[(3-chlorophenyl)methyl]-6-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-[(3-chlorophenyl)methyl]-6-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-[(3-chlorophenyl)methyl]-6-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(3-chlorobenzyl)-6-ethyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H18ClN5O2 MolecularWeight: 371.82082

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C18H18ClN5O2/c1-4-22-11(2)9-23-14-15(20-17(22)23)21(3)18(26)24(16(14)25)10-12-6-5-7-13(19)8-12/h5-9H,4,10H2,1-3H3