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

Systemtic Name: 8-chloranyl-7-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-[(2-chloro-7,8-dimethyl-3-quinolinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-[(2-chloro-7,8-dimethylquinolin-3-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1,3-dimethyl-xanthine Formula: C19H17Cl2N5O2 MolecularWeight: 418.27658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C)Cl)C

InChI

InChI=1S/C19H17Cl2N5O2/c1-9-5-6-11-7-12(15(20)22-13(11)10(9)2)8-26-14-16(23-18(26)21)24(3)19(28)25(4)17(14)27/h5-7H,8H2,1-4H3