8-[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]hydrazinyl]-7-ethyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]hydrazinyl]-7-ethyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-[(2Z)-2-[(5-bromo-2-methoxy-phenyl)methylene]hydrazino]-7-ethyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl]-7-ethyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl]-7-ethyl-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[(N'Z)-N'-(5-bromo-2-methoxy-benzylidene)hydrazino]-7-ethyl-1,3-dimethyl-xanthine Formula: C17H19BrN6O3 MolecularWeight: 435.27516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1NN=CC3=C(C=CC(=C3)Br)OC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1N/N=C\C3=C(C=CC(=C3)Br)OC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C17H19BrN6O3/c1-5-24-13-14(22(2)17(26)23(3)15(13)25)20-16(24)21-19-9-10-8-11(18)6-7-12(10)27-4/h6-9H,5H2,1-4H3,(H,20,21)/b19-9-