8-chloranyl-7-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-chloranyl-7-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-[(3-chloro-4-methyl-2-quinolyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-[(3-chloro-4-methyl-2-quinolinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-[(3-chloro-4-methylquinolin-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-[(3-chloro-4-methyl-2-quinolyl)methyl]-1,3-dimethyl-xanthine Formula: C18H15Cl2N5O2 MolecularWeight: 404.25

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C)Cl

InChI

InChI=1S/C18H15Cl2N5O2/c1-9-10-6-4-5-7-11(10)21-12(13(9)19)8-25-14-15(22-17(25)20)23(2)18(27)24(3)16(14)26/h4-7H,8H2,1-3H3