9-(5-chloranyl-2-methoxy-phenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: 9-(5-chloranyl-2-methoxy-phenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 9-(5-chloro-2-methoxy-phenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione CAS Name: 9-(5-chloro-2-methoxyphenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 9-(5-chloro-2-methoxyphenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 9-(5-chloro-2-methoxy-phenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-quinone Formula: C17H18ClN5O3 MolecularWeight: 375.80952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3CCCN(C3=N2)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3CCCN(C3=N2)C4=C(C=CC(=C4)Cl)OC

InChI

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