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

Systemtic Name: 8-[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]hydrazinyl]-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-[(2Z)-2-[(5-bromo-2-methoxy-phenyl)methylene]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl]-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-[(N'Z)-N'-(5-bromo-2-methoxy-benzylidene)hydrazino]-1,3,7-trimethyl-xanthine Formula: C16H17BrN6O3 MolecularWeight: 421.24858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NN=CC3=C(C=CC(=C3)Br)OC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1N/N=C\C3=C(C=CC(=C3)Br)OC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H17BrN6O3/c1-21-12-13(22(2)16(25)23(3)14(12)24)19-15(21)20-18-8-9-7-10(17)5-6-11(9)26-4/h5-8H,1-4H3,(H,19,20)/b18-8-