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

Systemtic Name: 7-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(3-chloro-4-methyl-2-quinolyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(3-chloro-4-methyl-2-quinolinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(3-chloro-4-methylquinolin-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(3-chloro-4-methyl-2-quinolyl)methyl]-1,3-dimethyl-xanthine Formula: C18H16ClN5O2 MolecularWeight: 369.80494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)Cl

InChI

InChI=1S/C18H16ClN5O2/c1-10-11-6-4-5-7-12(11)21-13(14(10)19)8-24-9-20-16-15(24)17(25)23(3)18(26)22(16)2/h4-7,9H,8H2,1-3H3